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

Systemtic Name: (4Z)-2-methyl-4-[5-(3-nitrophenyl)-1-pyridin-4-ylcarbonyl-pyrazolidin-3-ylidene]cyclohexa-2,5-dien-1-one Openeye Name: (4Z)-2-methyl-4-[5-(3-nitrophenyl)-1-(pyridine-4-carbonyl)pyrazolidin-3-ylidene]cyclohexa-2,5-dien-1-one CAS Name: (4Z)-2-methyl-4-[5-(3-nitrophenyl)-1-[oxo(pyridin-4-yl)methyl]-3-pyrazolidinylidene]-1-cyclohexa-2,5-dienone IUPAC Name: (4Z)-2-methyl-4-[5-(3-nitrophenyl)-1-(pyridine-4-carbonyl)pyrazolidin-3-ylidene]cyclohexa-2,5-dien-1-one Traditional Name: (4Z)-4-[1-isonicotinoyl-5-(3-nitrophenyl)pyrazolidin-3-ylidene]-2-methyl-cyclohexa-2,5-dien-1-one Formula: C22H18N4O4 MolecularWeight: 402.40272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2CC(N(N2)C(=O)C3=CC=NC=C3)C4=CC(=CC=C4)[N+](=O)[O-])C=CC1=O

Isomeric SMILES

CC1=C/C(=C\2/CC(N(N2)C(=O)C3=CC=NC=C3)C4=CC(=CC=C4)[N+](=O)[O-])/C=CC1=O

InChI

InChI=1S/C22H18N4O4/c1-14-11-16(5-6-21(14)27)19-13-20(17-3-2-4-18(12-17)26(29)30)25(24-19)22(28)15-7-9-23-10-8-15/h2-12,20,24H,13H2,1H3/b19-16-