(4E)-4-[1-ethanoyl-5-(2-methylphenyl)pyrazolidin-3-ylidene]-3-oxidanyl-cyclohexa-2,5-dien-1-one

Systemtic Name: (4E)-4-[1-ethanoyl-5-(2-methylphenyl)pyrazolidin-3-ylidene]-3-oxidanyl-cyclohexa-2,5-dien-1-one Openeye Name: (4E)-4-[1-acetyl-5-(o-tolyl)pyrazolidin-3-ylidene]-3-hydroxy-cyclohexa-2,5-dien-1-one CAS Name: (4E)-4-[1-acetyl-5-(2-methylphenyl)-3-pyrazolidinylidene]-3-hydroxy-1-cyclohexa-2,5-dienone IUPAC Name: (4E)-4-[1-acetyl-5-(2-methylphenyl)pyrazolidin-3-ylidene]-3-hydroxycyclohexa-2,5-dien-1-one Traditional Name: (4E)-4-[1-acetyl-5-(o-tolyl)pyrazolidin-3-ylidene]-3-hydroxy-cyclohexa-2,5-dien-1-one Formula: C18H18N2O3 MolecularWeight: 310.34712

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2CC(=C3C=CC(=O)C=C3O)NN2C(=O)C

Isomeric SMILES

CC1=CC=CC=C1C2C/C(=C\3/C=CC(=O)C=C3O)/NN2C(=O)C

InChI

InChI=1S/C18H18N2O3/c1-11-5-3-4-6-14(11)17-10-16(19-20(17)12(2)21)15-8-7-13(22)9-18(15)23/h3-9,17,19,23H,10H2,1-2H3/b16-15+