(4E)-4-[4-(1,3-benzodioxol-5-yl)-5-methyl-1,2-dihydropyrazol-3-ylidene]-3-oxidanyl-cyclohexa-2,5-dien-1-one

Systemtic Name: (4E)-4-[4-(1,3-benzodioxol-5-yl)-5-methyl-1,2-dihydropyrazol-3-ylidene]-3-oxidanyl-cyclohexa-2,5-dien-1-one Openeye Name: (4E)-4-[4-(1,3-benzodioxol-5-yl)-5-methyl-1,2-dihydropyrazol-3-ylidene]-3-hydroxy-cyclohexa-2,5-dien-1-one CAS Name: (4E)-4-[4-(1,3-benzodioxol-5-yl)-5-methyl-1,2-dihydropyrazol-3-ylidene]-3-hydroxy-1-cyclohexa-2,5-dienone IUPAC Name: (4E)-4-[4-(1,3-benzodioxol-5-yl)-5-methyl-1,2-dihydropyrazol-3-ylidene]-3-hydroxycyclohexa-2,5-dien-1-one Traditional Name: (4E)-4-[4-(1,3-benzodioxol-5-yl)-5-methyl-3-pyrazolin-3-ylidene]-3-hydroxy-cyclohexa-2,5-dien-1-one Formula: C17H14N2O4 MolecularWeight: 310.30406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C2C=CC(=O)C=C2O)NN1)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=C(/C(=C\2/C=CC(=O)C=C2O)/NN1)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C17H14N2O4/c1-9-16(10-2-5-14-15(6-10)23-8-22-14)17(19-18-9)12-4-3-11(20)7-13(12)21/h2-7,18-19,21H,8H2,1H3/b17-12+