methyl 4-[(E)-3-[[4-cyano-2-(8-methoxy-4-methyl-quinolin-2-yl)pyrazol-3-yl]amino]-3-oxidanylidene-prop-1-enyl]benzoate

Systemtic Name: methyl 4-[(E)-3-[[4-cyano-2-(8-methoxy-4-methyl-quinolin-2-yl)pyrazol-3-yl]amino]-3-oxidanylidene-prop-1-enyl]benzoate Openeye Name: methyl 4-[(E)-3-[[4-cyano-2-(8-methoxy-4-methyl-2-quinolyl)pyrazol-3-yl]amino]-3-oxo-prop-1-enyl]benzoate CAS Name: 4-[(E)-3-[[4-cyano-2-(8-methoxy-4-methyl-2-quinolinyl)-3-pyrazolyl]amino]-3-oxoprop-1-enyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(E)-3-[[4-cyano-2-(8-methoxy-4-methylquinolin-2-yl)pyrazol-3-yl]amino]-3-oxoprop-1-enyl]benzoate Traditional Name: 4-[(E)-3-[[4-cyano-2-(8-methoxy-4-methyl-2-quinolyl)pyrazol-3-yl]amino]-3-keto-prop-1-enyl]benzoic acid methyl ester Formula: C26H21N5O4 MolecularWeight: 467.47604

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C=CC=C2OC)N3C(=C(C=N3)C#N)NC(=O)C=CC4=CC=C(C=C4)C(=O)OC

Isomeric SMILES

CC1=CC(=NC2=C1C=CC=C2OC)N3C(=C(C=N3)C#N)NC(=O)/C=C/C4=CC=C(C=C4)C(=O)OC

InChI

InChI=1S/C26H21N5O4/c1-16-13-22(29-24-20(16)5-4-6-21(24)34-2)31-25(19(14-27)15-28-31)30-23(32)12-9-17-7-10-18(11-8-17)26(33)35-3/h4-13,15H,1-3H3,(H,30,32)/b12-9+