(2-oxidanylideneazepan-3-yl) 4-methyl-3-[(3-methylphenyl)sulfamoyl]benzoate

Systemtic Name: (2-oxidanylideneazepan-3-yl) 4-methyl-3-[(3-methylphenyl)sulfamoyl]benzoate Openeye Name: (2-oxoazepan-3-yl) 4-methyl-3-(m-tolylsulfamoyl)benzoate CAS Name: 4-methyl-3-[(3-methylphenyl)sulfamoyl]benzoic acid (2-oxo-3-azepanyl) ester IUPAC Name: (2-oxoazepan-3-yl) 4-methyl-3-[(3-methylphenyl)sulfamoyl]benzoate Traditional Name: 4-methyl-3-(m-tolylsulfamoyl)benzoic acid (2-ketoazepan-3-yl) ester Formula: C21H24N2O5S MolecularWeight: 416.49066

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NS(=O)(=O)C2=C(C=CC(=C2)C(=O)OC3CCCCNC3=O)C

Isomeric SMILES

CC1=CC(=CC=C1)NS(=O)(=O)C2=C(C=CC(=C2)C(=O)OC3CCCCNC3=O)C

InChI

InChI=1S/C21H24N2O5S/c1-14-6-5-7-17(12-14)23-29(26,27)19-13-16(10-9-15(19)2)21(25)28-18-8-3-4-11-22-20(18)24/h5-7,9-10,12-13,18,23H,3-4,8,11H2,1-2H3,(H,22,24)