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Home> Encyclopedia > Hot Product Listed A   > AC1MN8UO
744228-77-1 structure

AC1MN8UO

Iupac Name:3-[(4-propan-2-ylphenyl)methylidene]-1,2-dihydrocyclopenta[b]quinoline-9-carboxylic acid
CAS No.:744228-77-1
Molecular Weight:343.426
Molecular Formula:C23H21NO2 (isomer)
Names and Identifiers
Synonyms

3-[(4-propan-2-ylphenyl)methylidene]-1,2-dihydrocyclopenta[b]quinoline-9-carboxylic acid 3-{[4-(propan-2-yl)phenyl]methylidene}-1h,2h,3h-cyclopenta[b]quinoline-9-carboxylic acid MCULE-8733024563 Z46108311

Inchi
InChI=1S/C23H21NO2/c1-14(2)16-9-7-15(8-10-16)13-17-11-12-19-21(23(25)26)18-5-3-4-6-20(18)24-22(17)19/h3-10,13-14H,11-12H2,1-2H3,(H,25,26)
InChkey
PPZXFQBXCQKTJW-UHFFFAOYSA-N
Canonical Smiles
CC(C)C1=CC=C(C=C1)C=C2CCC3=C(C4=CC=CC=C4N=C23)C(=O)O
Computational chemical data
  • Molecular Weight:343.426g/mol
  • Molecular Formula:C23H21NO2
  • Compound Is Canonicalized:True
  • Exact Mass:343.157
  • Monoisotopic Mass:343.157
  • Complexity:546
  • Rotatable Bond Count:3
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:3
  • Heavy Atom Count:26
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:1
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
 
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