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

Systemtic Name: 4-chloranyl-N-(2-oxidanylideneazepan-3-yl)-N-[(3-phenoxyphenyl)methyl]benzenesulfonamide Openeye Name: 4-chloro-N-(2-oxoazepan-3-yl)-N-[(3-phenoxyphenyl)methyl]benzenesulfonamide CAS Name: 4-chloro-N-(2-oxo-3-azepanyl)-N-[(3-phenoxyphenyl)methyl]benzenesulfonamide IUPAC Name: 4-chloro-N-(2-oxoazepan-3-yl)-N-[(3-phenoxyphenyl)methyl]benzenesulfonamide Traditional Name: 4-chloro-N-(2-ketoazepan-3-yl)-N-(3-phenoxybenzyl)benzenesulfonamide Formula: C25H25ClN2O4S MolecularWeight: 484.995

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)N(CC2=CC(=CC=C2)OC3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CCNC(=O)C(C1)N(CC2=CC(=CC=C2)OC3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H25ClN2O4S/c26-20-12-14-23(15-13-20)33(30,31)28(24-11-4-5-16-27-25(24)29)18-19-7-6-10-22(17-19)32-21-8-2-1-3-9-21/h1-3,6-10,12-15,17,24H,4-5,11,16,18H2,(H,27,29)