methyl 4-[(E)-3-[(4-methylsulfonylphenyl)amino]-3-oxidanylidene-prop-1-enyl]benzoate

Systemtic Name: methyl 4-[(E)-3-[(4-methylsulfonylphenyl)amino]-3-oxidanylidene-prop-1-enyl]benzoate Openeye Name: methyl 4-[(E)-3-(4-methylsulfonylanilino)-3-oxo-prop-1-enyl]benzoate CAS Name: 4-[(E)-3-(4-methylsulfonylanilino)-3-oxoprop-1-enyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(E)-3-(4-methylsulfonylanilino)-3-oxoprop-1-enyl]benzoate Traditional Name: 4-[(E)-3-keto-3-(4-mesylanilino)prop-1-enyl]benzoic acid methyl ester Formula: C18H17NO5S MolecularWeight: 359.39628

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C=CC(=O)NC2=CC=C(C=C2)S(=O)(=O)C

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)/C=C/C(=O)NC2=CC=C(C=C2)S(=O)(=O)C

InChI

InChI=1S/C18H17NO5S/c1-24-18(21)14-6-3-13(4-7-14)5-12-17(20)19-15-8-10-16(11-9-15)25(2,22)23/h3-12H,1-2H3,(H,19,20)/b12-5+