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Bicyclo[1.1.0]butane, 2-heptyl- structure
Bicyclo[1.1.0]butane, 2-heptyl- structure

Bicyclo[1.1.0]butane, 2-heptyl-

Iupac Name:4-fluoro-5-[[(2S)-2-methyl-1,4-diazepan-1-yl]sulfonyl]isoquinoline;dihydrate;hydrochloride
CAS No.:887375-67-9
Molecular Weight:395.9
1. Names and Identifiers
1.1 Name
Bicyclo[1.1.0]butane, 2-heptyl-
1.2 CAS No.
887375-67-9
1.3 CID
11625386
1.4 Molecular Formula
C19H24CLNO2S (isomer)
1.5 Inchi
InChI=1S/C15H18FN3O2S.ClH.2H2O/c1-11-8-17-6-3-7-19(11)22(20,21)14-5-2-4-12-9-18-10-13(16)15(12)14;;;/h2,4-5,9-11,17H,3,6-8H2,1H3;1H;2*1H2/t11-;;;/m0.../s1
1.6 InChkey
CMDJNMACGABCKQ-XVSRHIFFSA-N
1.7 Canonical Smiles
CC1CNCCCN1S(=O)(=O)C2=CC=CC3=CN=CC(=C32)F.O.O.Cl
1.8 Isomers Smiles
C[C@H]1CNCCCN1S(=O)(=O)C2=CC=CC3=CN=CC(=C32)F.O.O.Cl
2. Safety and Handling
2.1 Risk Statements
24/25-26-28
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