5-(azepan-1-ylcarbonyl)-N-(4-bromophenyl)-2-methoxy-benzenesulfonamide

Systemtic Name: 5-(azepan-1-ylcarbonyl)-N-(4-bromophenyl)-2-methoxy-benzenesulfonamide Openeye Name: 5-(azepane-1-carbonyl)-N-(4-bromophenyl)-2-methoxy-benzenesulfonamide CAS Name: 5-[1-azepanyl(oxo)methyl]-N-(4-bromophenyl)-2-methoxybenzenesulfonamide IUPAC Name: 5-(azepane-1-carbonyl)-N-(4-bromophenyl)-2-methoxybenzenesulfonamide Traditional Name: 5-(azepane-1-carbonyl)-N-(4-bromophenyl)-2-methoxy-benzenesulfonamide Formula: C20H23BrN2O4S MolecularWeight: 467.37662

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N2CCCCCC2)S(=O)(=O)NC3=CC=C(C=C3)Br

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N2CCCCCC2)S(=O)(=O)NC3=CC=C(C=C3)Br

InChI

InChI=1S/C20H23BrN2O4S/c1-27-18-11-6-15(20(24)23-12-4-2-3-5-13-23)14-19(18)28(25,26)22-17-9-7-16(21)8-10-17/h6-11,14,22H,2-5,12-13H2,1H3