[2-(cyclopropylamino)-2-oxidanylidene-1-phenyl-ethyl] 4-methoxy-3-sulfamoyl-benzoate

Systemtic Name: [2-(cyclopropylamino)-2-oxidanylidene-1-phenyl-ethyl] 4-methoxy-3-sulfamoyl-benzoate Openeye Name: [2-(cyclopropylamino)-2-oxo-1-phenyl-ethyl] 4-methoxy-3-sulfamoyl-benzoate CAS Name: 4-methoxy-3-sulfamoylbenzoic acid [2-(cyclopropylamino)-2-oxo-1-phenylethyl] ester IUPAC Name: [2-(cyclopropylamino)-2-oxo-1-phenylethyl] 4-methoxy-3-sulfamoylbenzoate Traditional Name: 4-methoxy-3-sulfamoyl-benzoic acid [2-(cyclopropylamino)-2-keto-1-phenyl-ethyl] ester Formula: C19H20N2O6S MolecularWeight: 404.4369

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)OC(C2=CC=CC=C2)C(=O)NC3CC3)S(=O)(=O)N

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)OC(C2=CC=CC=C2)C(=O)NC3CC3)S(=O)(=O)N

InChI

InChI=1S/C19H20N2O6S/c1-26-15-10-7-13(11-16(15)28(20,24)25)19(23)27-17(12-5-3-2-4-6-12)18(22)21-14-8-9-14/h2-7,10-11,14,17H,8-9H2,1H3,(H,21,22)(H2,20,24,25)