3-(azepan-1-ylcarbonyl)-N-[(4-chlorophenyl)methyl]-4-methoxy-N-methyl-benzenesulfonamide

Systemtic Name: 3-(azepan-1-ylcarbonyl)-N-[(4-chlorophenyl)methyl]-4-methoxy-N-methyl-benzenesulfonamide Openeye Name: 3-(azepane-1-carbonyl)-N-[(4-chlorophenyl)methyl]-4-methoxy-N-methyl-benzenesulfonamide CAS Name: 3-[1-azepanyl(oxo)methyl]-N-[(4-chlorophenyl)methyl]-4-methoxy-N-methylbenzenesulfonamide IUPAC Name: 3-(azepane-1-carbonyl)-N-[(4-chlorophenyl)methyl]-4-methoxy-N-methylbenzenesulfonamide Traditional Name: 3-(azepane-1-carbonyl)-N-(4-chlorobenzyl)-4-methoxy-N-methyl-benzenesulfonamide Formula: C22H27ClN2O4S MolecularWeight: 450.97878

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)Cl)S(=O)(=O)C2=CC(=C(C=C2)OC)C(=O)N3CCCCCC3

Isomeric SMILES

CN(CC1=CC=C(C=C1)Cl)S(=O)(=O)C2=CC(=C(C=C2)OC)C(=O)N3CCCCCC3

InChI

InChI=1S/C22H27ClN2O4S/c1-24(16-17-7-9-18(23)10-8-17)30(27,28)19-11-12-21(29-2)20(15-19)22(26)25-13-5-3-4-6-14-25/h7-12,15H,3-6,13-14,16H2,1-2H3