methyl 3-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-5-pyridin-3-yl-1H-pyrazole-2-carboxylate

Systemtic Name: methyl 3-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-5-pyridin-3-yl-1H-pyrazole-2-carboxylate Openeye Name: methyl 3-(4-oxocyclohexa-2,5-dien-1-ylidene)-5-(3-pyridyl)-1H-pyrazole-2-carboxylate CAS Name: 3-(4-oxo-1-cyclohexa-2,5-dienylidene)-5-(3-pyridinyl)-1H-pyrazole-2-carboxylic acid methyl ester IUPAC Name: methyl 3-(4-oxocyclohexa-2,5-dien-1-ylidene)-5-pyridin-3-yl-1H-pyrazole-2-carboxylate Traditional Name: 5-(4-ketocyclohexa-2,5-dien-1-ylidene)-3-(3-pyridyl)-3-pyrazoline-1-carboxylic acid methyl ester Formula: C16H13N3O3 MolecularWeight: 295.29272

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)N1C(=C2C=CC(=O)C=C2)C=C(N1)C3=CN=CC=C3

Isomeric SMILES

COC(=O)N1C(=C2C=CC(=O)C=C2)C=C(N1)C3=CN=CC=C3

InChI

InChI=1S/C16H13N3O3/c1-22-16(21)19-15(11-4-6-13(20)7-5-11)9-14(18-19)12-3-2-8-17-10-12/h2-10,18H,1H3