ethyl 2-[5-(2-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-4-quinolin-2-yl-1H-pyrazol-2-yl]ethanoate

Systemtic Name: ethyl 2-[5-(2-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-4-quinolin-2-yl-1H-pyrazol-2-yl]ethanoate Openeye Name: ethyl 2-[5-(2-hydroxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)-4-(2-quinolyl)-1H-pyrazol-2-yl]acetate CAS Name: 2-[5-(2-hydroxy-4-oxo-1-cyclohexa-2,5-dienylidene)-4-(2-quinolinyl)-1H-pyrazol-2-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[5-(2-hydroxy-4-oxocyclohexa-2,5-dien-1-ylidene)-4-quinolin-2-yl-1H-pyrazol-2-yl]acetate Traditional Name: 2-[3-(2-hydroxy-4-keto-cyclohexa-2,5-dien-1-ylidene)-4-(2-quinolyl)-3-pyrazolin-1-yl]acetic acid ethyl ester Formula: C22H19N3O4 MolecularWeight: 389.40396

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C=C(C(=C2C=CC(=O)C=C2O)N1)C3=NC4=CC=CC=C4C=C3

Isomeric SMILES

CCOC(=O)CN1C=C(C(=C2C=CC(=O)C=C2O)N1)C3=NC4=CC=CC=C4C=C3

InChI

InChI=1S/C22H19N3O4/c1-2-29-21(28)13-25-12-17(19-10-7-14-5-3-4-6-18(14)23-19)22(24-25)16-9-8-15(26)11-20(16)27/h3-12,24,27H,2,13H2,1H3