ethyl 4-[(E)-2-cyano-3-[(4-ethoxyphenyl)amino]-3-oxidanylidene-prop-1-enyl]-1-phenyl-pyrazole-3-carboxylate

Systemtic Name: ethyl 4-[(E)-2-cyano-3-[(4-ethoxyphenyl)amino]-3-oxidanylidene-prop-1-enyl]-1-phenyl-pyrazole-3-carboxylate Openeye Name: ethyl 4-[(E)-2-cyano-3-(4-ethoxyanilino)-3-oxo-prop-1-enyl]-1-phenyl-pyrazole-3-carboxylate CAS Name: 4-[(E)-2-cyano-3-(4-ethoxyanilino)-3-oxoprop-1-enyl]-1-phenyl-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(E)-2-cyano-3-(4-ethoxyanilino)-3-oxoprop-1-enyl]-1-phenylpyrazole-3-carboxylate Traditional Name: 4-[(E)-2-cyano-3-keto-3-(p-phenetidino)prop-1-enyl]-1-phenyl-pyrazole-3-carboxylic acid ethyl ester Formula: C24H22N4O4 MolecularWeight: 430.45588

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)C(=CC2=CN(N=C2C(=O)OCC)C3=CC=CC=C3)C#N

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)/C(=C/C2=CN(N=C2C(=O)OCC)C3=CC=CC=C3)/C#N

InChI

InChI=1S/C24H22N4O4/c1-3-31-21-12-10-19(11-13-21)26-23(29)17(15-25)14-18-16-28(20-8-6-5-7-9-20)27-22(18)24(30)32-4-2/h5-14,16H,3-4H2,1-2H3,(H,26,29)/b17-14+