[1-(naphthalen-2-ylamino)-1-oxidanylidene-propan-2-yl] 4-methoxy-3-sulfamoyl-benzoate

Systemtic Name: [1-(naphthalen-2-ylamino)-1-oxidanylidene-propan-2-yl] 4-methoxy-3-sulfamoyl-benzoate Openeye Name: [1-methyl-2-(2-naphthylamino)-2-oxo-ethyl] 4-methoxy-3-sulfamoyl-benzoate CAS Name: 4-methoxy-3-sulfamoylbenzoic acid [1-(2-naphthalenylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(naphthalen-2-ylamino)-1-oxopropan-2-yl] 4-methoxy-3-sulfamoylbenzoate Traditional Name: 4-methoxy-3-sulfamoyl-benzoic acid [2-keto-1-methyl-2-(2-naphthylamino)ethyl] ester Formula: C21H20N2O6S MolecularWeight: 428.4583

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC2=CC=CC=C2C=C1)OC(=O)C3=CC(=C(C=C3)OC)S(=O)(=O)N

Isomeric SMILES

CC(C(=O)NC1=CC2=CC=CC=C2C=C1)OC(=O)C3=CC(=C(C=C3)OC)S(=O)(=O)N

InChI

InChI=1S/C21H20N2O6S/c1-13(20(24)23-17-9-7-14-5-3-4-6-15(14)11-17)29-21(25)16-8-10-18(28-2)19(12-16)30(22,26)27/h3-13H,1-2H3,(H,23,24)(H2,22,26,27)