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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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