[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl] 2-methoxy-5-sulfamoyl-benzoate

Systemtic Name: [2-oxidanylidene-2-[(phenylmethyl)amino]ethyl] 2-methoxy-5-sulfamoyl-benzoate Openeye Name: [2-(benzylamino)-2-oxo-ethyl] 2-methoxy-5-sulfamoyl-benzoate CAS Name: 2-methoxy-5-sulfamoylbenzoic acid [2-oxo-2-[(phenylmethyl)amino]ethyl] ester IUPAC Name: [2-(benzylamino)-2-oxoethyl] 2-methoxy-5-sulfamoylbenzoate Traditional Name: 2-methoxy-5-sulfamoyl-benzoic acid [2-(benzylamino)-2-keto-ethyl] ester Formula: C17H18N2O6S MolecularWeight: 378.39962

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N)C(=O)OCC(=O)NCC2=CC=CC=C2

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N)C(=O)OCC(=O)NCC2=CC=CC=C2

InChI

InChI=1S/C17H18N2O6S/c1-24-15-8-7-13(26(18,22)23)9-14(15)17(21)25-11-16(20)19-10-12-5-3-2-4-6-12/h2-9H,10-11H2,1H3,(H,19,20)(H2,18,22,23)