3-(azepan-1-ylcarbonyl)-4-methoxy-N-[1-(4-methylphenyl)ethyl]benzenesulfonamide

Systemtic Name: 3-(azepan-1-ylcarbonyl)-4-methoxy-N-[1-(4-methylphenyl)ethyl]benzenesulfonamide Openeye Name: 3-(azepane-1-carbonyl)-4-methoxy-N-[1-(p-tolyl)ethyl]benzenesulfonamide CAS Name: 3-[1-azepanyl(oxo)methyl]-4-methoxy-N-[1-(4-methylphenyl)ethyl]benzenesulfonamide IUPAC Name: 3-(azepane-1-carbonyl)-4-methoxy-N-[1-(4-methylphenyl)ethyl]benzenesulfonamide Traditional Name: 3-(azepane-1-carbonyl)-4-methoxy-N-[1-(p-tolyl)ethyl]benzenesulfonamide Formula: C23H30N2O4S MolecularWeight: 430.5603

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C)NS(=O)(=O)C2=CC(=C(C=C2)OC)C(=O)N3CCCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)C(C)NS(=O)(=O)C2=CC(=C(C=C2)OC)C(=O)N3CCCCCC3

InChI

InChI=1S/C23H30N2O4S/c1-17-8-10-19(11-9-17)18(2)24-30(27,28)20-12-13-22(29-3)21(16-20)23(26)25-14-6-4-5-7-15-25/h8-13,16,18,24H,4-7,14-15H2,1-3H3