4-[(E)-(3-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]-2-phenyl-5-pyridin-4-yl-1H-pyrazol-3-one

Systemtic Name: 4-[(E)-(3-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]-2-phenyl-5-pyridin-4-yl-1H-pyrazol-3-one Openeye Name: 4-[(E)-(3-methoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)methyl]-2-phenyl-5-(4-pyridyl)-1H-pyrazol-3-one CAS Name: 4-[(E)-(3-methoxy-4-oxo-1-cyclohexa-2,5-dienylidene)methyl]-2-phenyl-5-pyridin-4-yl-1H-pyrazol-3-one IUPAC Name: 4-[(E)-(3-methoxy-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]-2-phenyl-5-pyridin-4-yl-1H-pyrazol-3-one Traditional Name: 4-[(E)-(4-keto-3-methoxy-cyclohexa-2,5-dien-1-ylidene)methyl]-2-phenyl-5-(4-pyridyl)-3-pyrazolin-3-one Formula: C22H17N3O3 MolecularWeight: 371.38868

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC2=C(NN(C2=O)C3=CC=CC=C3)C4=CC=NC=C4)C=CC1=O

Isomeric SMILES

COC1=C/C(=C/C2=C(NN(C2=O)C3=CC=CC=C3)C4=CC=NC=C4)/C=CC1=O

InChI

InChI=1S/C22H17N3O3/c1-28-20-14-15(7-8-19(20)26)13-18-21(16-9-11-23-12-10-16)24-25(22(18)27)17-5-3-2-4-6-17/h2-14,24H,1H3/b15-13+