3-(azepan-1-ylcarbonyl)-N-(5-chloranyl-2-methoxy-phenyl)benzenesulfonamide

Systemtic Name: 3-(azepan-1-ylcarbonyl)-N-(5-chloranyl-2-methoxy-phenyl)benzenesulfonamide Openeye Name: 3-(azepane-1-carbonyl)-N-(5-chloro-2-methoxy-phenyl)benzenesulfonamide CAS Name: 3-[1-azepanyl(oxo)methyl]-N-(5-chloro-2-methoxyphenyl)benzenesulfonamide IUPAC Name: 3-(azepane-1-carbonyl)-N-(5-chloro-2-methoxyphenyl)benzenesulfonamide Traditional Name: 3-(azepane-1-carbonyl)-N-(5-chloro-2-methoxy-phenyl)benzenesulfonamide Formula: C20H23ClN2O4S MolecularWeight: 422.92562

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)NS(=O)(=O)C2=CC=CC(=C2)C(=O)N3CCCCCC3

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)NS(=O)(=O)C2=CC=CC(=C2)C(=O)N3CCCCCC3

InChI

InChI=1S/C20H23ClN2O4S/c1-27-19-10-9-16(21)14-18(19)22-28(25,26)17-8-6-7-15(13-17)20(24)23-11-4-2-3-5-12-23/h6-10,13-14,22H,2-5,11-12H2,1H3