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Home> Hot Product Listed 9   > 9-ETHYL-8-OXO-6,7,8,9-TETRAHYDRO-5H-CARBAZOLE-3-CARBOXYLIC ACID
1883284-94-3 structure

9-ETHYL-8-OXO-6,7,8,9-TETRAHYDRO-5H-CARBAZOLE-3-CARBOXYLIC ACID

Iupac Name:naphthalen-1-yl 1-[(4-fluorophenyl)methyl]indole-3-carboxylate
CAS No.:1883284-94-3
Molecular Weight:395.433g/mol
Molecular Formula:C12H12N2O (isomer)
Names and Identifiers
Synonyms

9-ETHYL-1-OXO-2,3,4,9-TETRAHYDRO-1H-CARBAZOLE-6-CARBOXYLIC ACID CHEMBRDG-BB 6150516 TIMTEC-BB SBB012018

Inchi
InChI=1S/C26H18FNO2/c27-20-14-12-18(13-15-20)16-28-17-23(22-9-3-4-10-24(22)28)26(29)30-25-11-5-7-19-6-1-2-8-21(19)25/h1-15,17H,16H2
InChkey
RCEKSVIFQKKFLS-UHFFFAOYSA-N
Canonical Smiles
C1=CC=C2C(=C1)C=CC=C2OC(=O)C3=CN(C4=CC=CC=C43)CC5=CC=C(C=C5)F
Computational chemical data
  • Molecular Weight:395.433g/molg/mol
  • Molecular Formula:C12H12N2O
  • Compound Is Canonicalized:True
  • Exact Mass:395.132
  • Monoisotopic Mass:395.132
  • Complexity:590
  • Rotatable Bond Count:5
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:3
  • Topological Polar Surface Area:31.2A^2
  • Heavy Atom Count:30
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
  • CACTVS Substructure Key Fingerprint: AAADceB6MQAAAAAAAAAAAAAAAAAAAWAAAAAwYMGAAAAAAFjB9AAAHwAAAAAADAzBngw8zvMMFACo AzT3TACCiCA1IiAI2CE+bNgMJvrEtZuGO6jmwBHI6ce8yPCOgAABAAAaAAAAAAIAADQAAAAAAAAA AA==
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