N-[2-(azepan-1-ylcarbonyl)phenyl]-4-methoxy-N-(phenylmethyl)benzenesulfonamide

Systemtic Name: N-[2-(azepan-1-ylcarbonyl)phenyl]-4-methoxy-N-(phenylmethyl)benzenesulfonamide Openeye Name: N-[2-(azepane-1-carbonyl)phenyl]-N-benzyl-4-methoxy-benzenesulfonamide CAS Name: N-[2-[1-azepanyl(oxo)methyl]phenyl]-4-methoxy-N-(phenylmethyl)benzenesulfonamide IUPAC Name: N-[2-(azepane-1-carbonyl)phenyl]-N-benzyl-4-methoxybenzenesulfonamide Traditional Name: N-[2-(azepane-1-carbonyl)phenyl]-N-benzyl-4-methoxy-benzenesulfonamide Formula: C27H30N2O4S MolecularWeight: 478.6031

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2)C3=CC=CC=C3C(=O)N4CCCCCC4

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2)C3=CC=CC=C3C(=O)N4CCCCCC4

InChI

InChI=1S/C27H30N2O4S/c1-33-23-15-17-24(18-16-23)34(31,32)29(21-22-11-5-4-6-12-22)26-14-8-7-13-25(26)27(30)28-19-9-2-3-10-20-28/h4-8,11-18H,2-3,9-10,19-21H2,1H3