(6E)-6-[4-(1,3-benzodioxol-5-yl)-1,2-dihydropyrazol-3-ylidene]-3-oxidanyl-4-propan-2-yl-cyclohexa-2,4-dien-1-one

Systemtic Name: (6E)-6-[4-(1,3-benzodioxol-5-yl)-1,2-dihydropyrazol-3-ylidene]-3-oxidanyl-4-propan-2-yl-cyclohexa-2,4-dien-1-one Openeye Name: (6E)-6-[4-(1,3-benzodioxol-5-yl)-1,2-dihydropyrazol-3-ylidene]-3-hydroxy-4-isopropyl-cyclohexa-2,4-dien-1-one CAS Name: (6E)-6-[4-(1,3-benzodioxol-5-yl)-1,2-dihydropyrazol-3-ylidene]-3-hydroxy-4-propan-2-yl-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-6-[4-(1,3-benzodioxol-5-yl)-1,2-dihydropyrazol-3-ylidene]-3-hydroxy-4-propan-2-ylcyclohexa-2,4-dien-1-one Traditional Name: (6E)-6-[4-(1,3-benzodioxol-5-yl)-3-pyrazolin-3-ylidene]-3-hydroxy-4-isopropyl-cyclohexa-2,4-dien-1-one Formula: C19H18N2O4 MolecularWeight: 338.35722

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C2C(=CNN2)C3=CC4=C(C=C3)OCO4)C(=O)C=C1O

Isomeric SMILES

CC(C)C1=C/C(=C\2/C(=CNN2)C3=CC4=C(C=C3)OCO4)/C(=O)C=C1O

InChI

InChI=1S/C19H18N2O4/c1-10(2)12-6-13(16(23)7-15(12)22)19-14(8-20-21-19)11-3-4-17-18(5-11)25-9-24-17/h3-8,10,20-22H,9H2,1-2H3/b19-13+