methyl 4-[(E)-3-[(4-cyano-2-quinolin-2-yl-pyrazol-3-yl)amino]-3-oxidanylidene-prop-1-enyl]benzoate

Systemtic Name: methyl 4-[(E)-3-[(4-cyano-2-quinolin-2-yl-pyrazol-3-yl)amino]-3-oxidanylidene-prop-1-enyl]benzoate Openeye Name: methyl 4-[(E)-3-[[4-cyano-2-(2-quinolyl)pyrazol-3-yl]amino]-3-oxo-prop-1-enyl]benzoate CAS Name: 4-[(E)-3-[[4-cyano-2-(2-quinolinyl)-3-pyrazolyl]amino]-3-oxoprop-1-enyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(E)-3-[(4-cyano-2-quinolin-2-ylpyrazol-3-yl)amino]-3-oxoprop-1-enyl]benzoate Traditional Name: 4-[(E)-3-[[4-cyano-2-(2-quinolyl)pyrazol-3-yl]amino]-3-keto-prop-1-enyl]benzoic acid methyl ester Formula: C24H17N5O3 MolecularWeight: 423.42348

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C=CC(=O)NC2=C(C=NN2C3=NC4=CC=CC=C4C=C3)C#N

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)/C=C/C(=O)NC2=C(C=NN2C3=NC4=CC=CC=C4C=C3)C#N

InChI

InChI=1S/C24H17N5O3/c1-32-24(31)18-9-6-16(7-10-18)8-13-22(30)28-23-19(14-25)15-26-29(23)21-12-11-17-4-2-3-5-20(17)27-21/h2-13,15H,1H3,(H,28,30)/b13-8+