(6E)-2,3-dimethoxy-6-(4-phenoxy-1,2-dihydropyrazol-3-ylidene)cyclohexa-2,4-dien-1-one

Systemtic Name: (6E)-2,3-dimethoxy-6-(4-phenoxy-1,2-dihydropyrazol-3-ylidene)cyclohexa-2,4-dien-1-one Openeye Name: (6E)-2,3-dimethoxy-6-(4-phenoxy-1,2-dihydropyrazol-3-ylidene)cyclohexa-2,4-dien-1-one CAS Name: (6E)-2,3-dimethoxy-6-(4-phenoxy-1,2-dihydropyrazol-3-ylidene)-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-2,3-dimethoxy-6-(4-phenoxy-1,2-dihydropyrazol-3-ylidene)cyclohexa-2,4-dien-1-one Traditional Name: (6E)-2,3-dimethoxy-6-(4-phenoxy-3-pyrazolin-3-ylidene)cyclohexa-2,4-dien-1-one Formula: C17H16N2O4 MolecularWeight: 312.31994

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=O)C(=C2C(=CNN2)OC3=CC=CC=C3)C=C1)OC

Isomeric SMILES

COC1=C(C(=O)/C(=C/2\C(=CNN2)OC3=CC=CC=C3)/C=C1)OC

InChI

InChI=1S/C17H16N2O4/c1-21-13-9-8-12(16(20)17(13)22-2)15-14(10-18-19-15)23-11-6-4-3-5-7-11/h3-10,18-19H,1-2H3/b15-12+