[(4E)-4-(2-ethanoyl-4-pyridin-2-yl-1H-pyrazol-5-ylidene)-6-methyl-3-oxidanylidene-cyclohexa-1,5-dien-1-yl] ethanoate

Systemtic Name: [(4E)-4-(2-ethanoyl-4-pyridin-2-yl-1H-pyrazol-5-ylidene)-6-methyl-3-oxidanylidene-cyclohexa-1,5-dien-1-yl] ethanoate Openeye Name: [(4E)-4-[2-acetyl-4-(2-pyridyl)-1H-pyrazol-5-ylidene]-6-methyl-3-oxo-cyclohexa-1,5-dien-1-yl] acetate CAS Name: acetic acid [(4E)-4-[2-acetyl-4-(2-pyridinyl)-1H-pyrazol-5-ylidene]-6-methyl-3-oxo-1-cyclohexa-1,5-dienyl] ester IUPAC Name: [(4E)-4-(2-acetyl-4-pyridin-2-yl-1H-pyrazol-5-ylidene)-6-methyl-3-oxocyclohexa-1,5-dien-1-yl] acetate Traditional Name: acetic acid [(4E)-4-[1-acetyl-4-(2-pyridyl)-3-pyrazolin-3-ylidene]-3-keto-6-methyl-cyclohexa-1,5-dien-1-yl] ester Formula: C19H17N3O4 MolecularWeight: 351.35598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=CN(N2)C(=O)C)C3=CC=CC=N3)C(=O)C=C1OC(=O)C

Isomeric SMILES

CC1=C/C(=C\2/C(=CN(N2)C(=O)C)C3=CC=CC=N3)/C(=O)C=C1OC(=O)C

InChI

InChI=1S/C19H17N3O4/c1-11-8-14(17(25)9-18(11)26-13(3)24)19-15(10-22(21-19)12(2)23)16-6-4-5-7-20-16/h4-10,21H,1-3H3/b19-14+