3-butoxy-6-(5-methyl-4-phenoxy-1,2-dihydropyrazol-3-ylidene)cyclohexa-2,4-dien-1-one

Systemtic Name: 3-butoxy-6-(5-methyl-4-phenoxy-1,2-dihydropyrazol-3-ylidene)cyclohexa-2,4-dien-1-one Openeye Name: 3-butoxy-6-(5-methyl-4-phenoxy-1,2-dihydropyrazol-3-ylidene)cyclohexa-2,4-dien-1-one CAS Name: 3-butoxy-6-(5-methyl-4-phenoxy-1,2-dihydropyrazol-3-ylidene)-1-cyclohexa-2,4-dienone IUPAC Name: 3-butoxy-6-(5-methyl-4-phenoxy-1,2-dihydropyrazol-3-ylidene)cyclohexa-2,4-dien-1-one Traditional Name: 3-butoxy-6-(5-methyl-4-phenoxy-3-pyrazolin-3-ylidene)cyclohexa-2,4-dien-1-one Formula: C20H22N2O3 MolecularWeight: 338.40028

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC(=O)C(=C2C(=C(NN2)C)OC3=CC=CC=C3)C=C1

Isomeric SMILES

CCCCOC1=CC(=O)C(=C2C(=C(NN2)C)OC3=CC=CC=C3)C=C1

InChI

InChI=1S/C20H22N2O3/c1-3-4-12-24-16-10-11-17(18(23)13-16)19-20(14(2)21-22-19)25-15-8-6-5-7-9-15/h5-11,13,21-22H,3-4,12H2,1-2H3