methyl 6-[(4-chlorophenyl)sulfonyl-(2-oxidanylideneazepan-3-yl)amino]hexanoate

Systemtic Name: methyl 6-[(4-chlorophenyl)sulfonyl-(2-oxidanylideneazepan-3-yl)amino]hexanoate Openeye Name: methyl 6-[(4-chlorophenyl)sulfonyl-(2-oxoazepan-3-yl)amino]hexanoate CAS Name: 6-[(4-chlorophenyl)sulfonyl-(2-oxo-3-azepanyl)amino]hexanoic acid methyl ester IUPAC Name: methyl 6-[(4-chlorophenyl)sulfonyl-(2-oxoazepan-3-yl)amino]hexanoate Traditional Name: 6-[(4-chlorophenyl)sulfonyl-(2-ketoazepan-3-yl)amino]hexanoic acid methyl ester Formula: C19H27ClN2O5S MolecularWeight: 430.94608

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCN(C1CCCCNC1=O)S(=O)(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

COC(=O)CCCCCN(C1CCCCNC1=O)S(=O)(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C19H27ClN2O5S/c1-27-18(23)8-3-2-6-14-22(17-7-4-5-13-21-19(17)24)28(25,26)16-11-9-15(20)10-12-16/h9-12,17H,2-8,13-14H2,1H3,(H,21,24)