4-[(3,5-dimethoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]-2-(4-ethylphenyl)-5-methyl-1H-pyrazol-3-one

Systemtic Name: 4-[(3,5-dimethoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]-2-(4-ethylphenyl)-5-methyl-1H-pyrazol-3-one Openeye Name: 4-[(3,5-dimethoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)methyl]-2-(4-ethylphenyl)-5-methyl-1H-pyrazol-3-one CAS Name: 4-[(3,5-dimethoxy-4-oxo-1-cyclohexa-2,5-dienylidene)methyl]-2-(4-ethylphenyl)-5-methyl-1H-pyrazol-3-one IUPAC Name: 4-[(3,5-dimethoxy-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]-2-(4-ethylphenyl)-5-methyl-1H-pyrazol-3-one Traditional Name: 2-(4-ethylphenyl)-4-[(4-keto-3,5-dimethoxy-cyclohexa-2,5-dien-1-ylidene)methyl]-5-methyl-3-pyrazolin-3-one Formula: C21H22N2O4 MolecularWeight: 366.41038

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2C(=O)C(=C(N2)C)C=C3C=C(C(=O)C(=C3)OC)OC

Isomeric SMILES

CCC1=CC=C(C=C1)N2C(=O)C(=C(N2)C)C=C3C=C(C(=O)C(=C3)OC)OC

InChI

InChI=1S/C21H22N2O4/c1-5-14-6-8-16(9-7-14)23-21(25)17(13(2)22-23)10-15-11-18(26-3)20(24)19(12-15)27-4/h6-12,22H,5H2,1-4H3