4-chloranyl-N-(2-oxidanylideneazepan-3-yl)-N-[(4-phenylmethoxyphenyl)methyl]benzenesulfonamide

Systemtic Name: 4-chloranyl-N-(2-oxidanylideneazepan-3-yl)-N-[(4-phenylmethoxyphenyl)methyl]benzenesulfonamide Openeye Name: N-[(4-benzyloxyphenyl)methyl]-4-chloro-N-(2-oxoazepan-3-yl)benzenesulfonamide CAS Name: 4-chloro-N-(2-oxo-3-azepanyl)-N-[(4-phenylmethoxyphenyl)methyl]benzenesulfonamide IUPAC Name: 4-chloro-N-(2-oxoazepan-3-yl)-N-[(4-phenylmethoxyphenyl)methyl]benzenesulfonamide Traditional Name: N-(4-benzoxybenzyl)-4-chloro-N-(2-ketoazepan-3-yl)benzenesulfonamide Formula: C26H27ClN2O4S MolecularWeight: 499.02158

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)N(CC2=CC=C(C=C2)OCC3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CCNC(=O)C(C1)N(CC2=CC=C(C=C2)OCC3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C26H27ClN2O4S/c27-22-11-15-24(16-12-22)34(31,32)29(25-8-4-5-17-28-26(25)30)18-20-9-13-23(14-10-20)33-19-21-6-2-1-3-7-21/h1-3,6-7,9-16,25H,4-5,8,17-19H2,(H,28,30)