[2-(azepan-1-yl)-2-oxidanylidene-ethyl] 2-chloranyl-5-[ethyl(phenyl)sulfamoyl]benzoate

Systemtic Name: [2-(azepan-1-yl)-2-oxidanylidene-ethyl] 2-chloranyl-5-[ethyl(phenyl)sulfamoyl]benzoate Openeye Name: [2-(azepan-1-yl)-2-oxo-ethyl] 2-chloro-5-[ethyl(phenyl)sulfamoyl]benzoate CAS Name: 2-chloro-5-[ethyl(phenyl)sulfamoyl]benzoic acid [2-(1-azepanyl)-2-oxoethyl] ester IUPAC Name: [2-(azepan-1-yl)-2-oxoethyl] 2-chloro-5-[ethyl(phenyl)sulfamoyl]benzoate Traditional Name: 2-chloro-5-[ethyl(phenyl)sulfamoyl]benzoic acid [2-(azepan-1-yl)-2-keto-ethyl] ester Formula: C23H27ClN2O5S MolecularWeight: 478.98888

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)OCC(=O)N3CCCCCC3

Isomeric SMILES

CCN(C1=CC=CC=C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)OCC(=O)N3CCCCCC3

InChI

InChI=1S/C23H27ClN2O5S/c1-2-26(18-10-6-5-7-11-18)32(29,30)19-12-13-21(24)20(16-19)23(28)31-17-22(27)25-14-8-3-4-9-15-25/h5-7,10-13,16H,2-4,8-9,14-15,17H2,1H3