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

Systemtic Name: 6-[4-(1,3-benzodioxol-5-yl)-1,2-dihydropyrazol-3-ylidene]-4-ethyl-3-oxidanyl-cyclohexa-2,4-dien-1-one Openeye Name: 6-[4-(1,3-benzodioxol-5-yl)-1,2-dihydropyrazol-3-ylidene]-4-ethyl-3-hydroxy-cyclohexa-2,4-dien-1-one CAS Name: 6-[4-(1,3-benzodioxol-5-yl)-1,2-dihydropyrazol-3-ylidene]-4-ethyl-3-hydroxy-1-cyclohexa-2,4-dienone IUPAC Name: 6-[4-(1,3-benzodioxol-5-yl)-1,2-dihydropyrazol-3-ylidene]-4-ethyl-3-hydroxycyclohexa-2,4-dien-1-one Traditional Name: 6-[4-(1,3-benzodioxol-5-yl)-3-pyrazolin-3-ylidene]-4-ethyl-3-hydroxy-cyclohexa-2,4-dien-1-one Formula: C18H16N2O4 MolecularWeight: 324.33064

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C2C(=CNN2)C3=CC4=C(C=C3)OCO4)C(=O)C=C1O

Isomeric SMILES

CCC1=CC(=C2C(=CNN2)C3=CC4=C(C=C3)OCO4)C(=O)C=C1O

InChI

InChI=1S/C18H16N2O4/c1-2-10-5-12(15(22)7-14(10)21)18-13(8-19-20-18)11-3-4-16-17(6-11)24-9-23-16/h3-8,19-21H,2,9H2,1H3