[1-[(4-methoxyphenyl)methylamino]-1-oxidanylidene-propan-2-yl] 4-methyl-3-sulfamoyl-benzoate

Systemtic Name: [1-[(4-methoxyphenyl)methylamino]-1-oxidanylidene-propan-2-yl] 4-methyl-3-sulfamoyl-benzoate Openeye Name: [2-[(4-methoxyphenyl)methylamino]-1-methyl-2-oxo-ethyl] 4-methyl-3-sulfamoyl-benzoate CAS Name: 4-methyl-3-sulfamoylbenzoic acid [1-[(4-methoxyphenyl)methylamino]-1-oxopropan-2-yl] ester IUPAC Name: [1-[(4-methoxyphenyl)methylamino]-1-oxopropan-2-yl] 4-methyl-3-sulfamoylbenzoate Traditional Name: 4-methyl-3-sulfamoyl-benzoic acid [2-keto-1-methyl-2-(p-anisylamino)ethyl] ester Formula: C19H22N2O6S MolecularWeight: 406.45278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC(C)C(=O)NCC2=CC=C(C=C2)OC)S(=O)(=O)N

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC(C)C(=O)NCC2=CC=C(C=C2)OC)S(=O)(=O)N

InChI

InChI=1S/C19H22N2O6S/c1-12-4-7-15(10-17(12)28(20,24)25)19(23)27-13(2)18(22)21-11-14-5-8-16(26-3)9-6-14/h4-10,13H,11H2,1-3H3,(H,21,22)(H2,20,24,25)