N-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-N-(4-phenoxyphenyl)methanesulfonamide

Systemtic Name: N-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-N-(4-phenoxyphenyl)methanesulfonamide Openeye Name: N-[2-(azepan-1-yl)-2-oxo-ethyl]-N-(4-phenoxyphenyl)methanesulfonamide CAS Name: N-[2-(1-azepanyl)-2-oxoethyl]-N-(4-phenoxyphenyl)methanesulfonamide IUPAC Name: N-[2-(azepan-1-yl)-2-oxoethyl]-N-(4-phenoxyphenyl)methanesulfonamide Traditional Name: N-[2-(azepan-1-yl)-2-keto-ethyl]-N-(4-phenoxyphenyl)methanesulfonamide Formula: C21H26N2O4S MolecularWeight: 402.50714

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC(=O)N1CCCCCC1)C2=CC=C(C=C2)OC3=CC=CC=C3

Isomeric SMILES

CS(=O)(=O)N(CC(=O)N1CCCCCC1)C2=CC=C(C=C2)OC3=CC=CC=C3

InChI

InChI=1S/C21H26N2O4S/c1-28(25,26)23(17-21(24)22-15-7-2-3-8-16-22)18-11-13-20(14-12-18)27-19-9-5-4-6-10-19/h4-6,9-14H,2-3,7-8,15-17H2,1H3