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

Systemtic Name: 4-[(3-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]-5-methyl-2-(2-phenylethanoyl)-1H-pyrazol-3-one Openeye Name: 4-[(3-methoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)methyl]-5-methyl-2-(2-phenylacetyl)-1H-pyrazol-3-one CAS Name: 4-[(3-methoxy-4-oxo-1-cyclohexa-2,5-dienylidene)methyl]-5-methyl-2-(1-oxo-2-phenylethyl)-1H-pyrazol-3-one IUPAC Name: 4-[(3-methoxy-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]-5-methyl-2-(2-phenylacetyl)-1H-pyrazol-3-one Traditional Name: 4-[(4-keto-3-methoxy-cyclohexa-2,5-dien-1-ylidene)methyl]-5-methyl-2-(2-phenylacetyl)-3-pyrazolin-3-one Formula: C20H18N2O4 MolecularWeight: 350.36792

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1)C(=O)CC2=CC=CC=C2)C=C3C=CC(=O)C(=C3)OC

Isomeric SMILES

CC1=C(C(=O)N(N1)C(=O)CC2=CC=CC=C2)C=C3C=CC(=O)C(=C3)OC

InChI

InChI=1S/C20H18N2O4/c1-13-16(10-15-8-9-17(23)18(11-15)26-2)20(25)22(21-13)19(24)12-14-6-4-3-5-7-14/h3-11,21H,12H2,1-2H3