[2-[(4-methylsulfonylphenyl)amino]-2-oxidanylidene-ethyl] 3,5-dimethoxy-4-methyl-benzoate

Systemtic Name: [2-[(4-methylsulfonylphenyl)amino]-2-oxidanylidene-ethyl] 3,5-dimethoxy-4-methyl-benzoate Openeye Name: [2-(4-methylsulfonylanilino)-2-oxo-ethyl] 3,5-dimethoxy-4-methyl-benzoate CAS Name: 3,5-dimethoxy-4-methylbenzoic acid [2-(4-methylsulfonylanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-methylsulfonylanilino)-2-oxoethyl] 3,5-dimethoxy-4-methylbenzoate Traditional Name: 3,5-dimethoxy-4-methyl-benzoic acid [2-keto-2-(4-mesylanilino)ethyl] ester Formula: C19H21NO7S MolecularWeight: 407.43754

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1OC)C(=O)OCC(=O)NC2=CC=C(C=C2)S(=O)(=O)C)OC

Isomeric SMILES

CC1=C(C=C(C=C1OC)C(=O)OCC(=O)NC2=CC=C(C=C2)S(=O)(=O)C)OC

InChI

InChI=1S/C19H21NO7S/c1-12-16(25-2)9-13(10-17(12)26-3)19(22)27-11-18(21)20-14-5-7-15(8-6-14)28(4,23)24/h5-10H,11H2,1-4H3,(H,20,21)