4-[5-(3,4-dimethoxyphenyl)-1-pyridin-3-ylcarbonyl-pyrazolidin-3-ylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[5-(3,4-dimethoxyphenyl)-1-pyridin-3-ylcarbonyl-pyrazolidin-3-ylidene]cyclohexa-2,5-dien-1-one Openeye Name: 4-[5-(3,4-dimethoxyphenyl)-1-(pyridine-3-carbonyl)pyrazolidin-3-ylidene]cyclohexa-2,5-dien-1-one CAS Name: 4-[5-(3,4-dimethoxyphenyl)-1-[oxo(3-pyridinyl)methyl]-3-pyrazolidinylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 4-[5-(3,4-dimethoxyphenyl)-1-(pyridine-3-carbonyl)pyrazolidin-3-ylidene]cyclohexa-2,5-dien-1-one Traditional Name: 4-[5-(3,4-dimethoxyphenyl)-1-nicotinoyl-pyrazolidin-3-ylidene]cyclohexa-2,5-dien-1-one Formula: C23H21N3O4 MolecularWeight: 403.43054

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2CC(=C3C=CC(=O)C=C3)NN2C(=O)C4=CN=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2CC(=C3C=CC(=O)C=C3)NN2C(=O)C4=CN=CC=C4)OC

InChI

InChI=1S/C23H21N3O4/c1-29-21-10-7-16(12-22(21)30-2)20-13-19(15-5-8-18(27)9-6-15)25-26(20)23(28)17-4-3-11-24-14-17/h3-12,14,20,25H,13H2,1-2H3