3-(azepan-1-ylcarbonyl)-N-[2,3-bis(chloranyl)phenyl]-4-methoxy-benzenesulfonamide

Systemtic Name: 3-(azepan-1-ylcarbonyl)-N-[2,3-bis(chloranyl)phenyl]-4-methoxy-benzenesulfonamide Openeye Name: 3-(azepane-1-carbonyl)-N-(2,3-dichlorophenyl)-4-methoxy-benzenesulfonamide CAS Name: 3-[1-azepanyl(oxo)methyl]-N-(2,3-dichlorophenyl)-4-methoxybenzenesulfonamide IUPAC Name: 3-(azepane-1-carbonyl)-N-(2,3-dichlorophenyl)-4-methoxybenzenesulfonamide Traditional Name: 3-(azepane-1-carbonyl)-N-(2,3-dichlorophenyl)-4-methoxy-benzenesulfonamide Formula: C20H22Cl2N2O4S MolecularWeight: 457.37068

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)NC2=C(C(=CC=C2)Cl)Cl)C(=O)N3CCCCCC3

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)NC2=C(C(=CC=C2)Cl)Cl)C(=O)N3CCCCCC3

InChI

InChI=1S/C20H22Cl2N2O4S/c1-28-18-10-9-14(13-15(18)20(25)24-11-4-2-3-5-12-24)29(26,27)23-17-8-6-7-16(21)19(17)22/h6-10,13,23H,2-5,11-12H2,1H3