4-(2,6-dipyridin-2-yl-1H-pyridin-4-ylidene)-2-nitro-cyclohexa-2,5-dien-1-one

Systemtic Name: 4-(2,6-dipyridin-2-yl-1H-pyridin-4-ylidene)-2-nitro-cyclohexa-2,5-dien-1-one Openeye Name: 4-[2,6-bis(2-pyridyl)-1H-pyridin-4-ylidene]-2-nitro-cyclohexa-2,5-dien-1-one CAS Name: 4-[2,6-bis(2-pyridinyl)-1H-pyridin-4-ylidene]-2-nitro-1-cyclohexa-2,5-dienone IUPAC Name: 4-(2,6-dipyridin-2-yl-1H-pyridin-4-ylidene)-2-nitrocyclohexa-2,5-dien-1-one Traditional Name: 4-[2,6-bis(2-pyridyl)-1H-pyridin-4-ylidene]-2-nitro-cyclohexa-2,5-dien-1-one Formula: C21H14N4O3 MolecularWeight: 370.36086

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C2=CC(=C3C=CC(=O)C(=C3)[N+](=O)[O-])C=C(N2)C4=CC=CC=N4

Isomeric SMILES

C1=CC=NC(=C1)C2=CC(=C3C=CC(=O)C(=C3)[N+](=O)[O-])C=C(N2)C4=CC=CC=N4

InChI

InChI=1S/C21H14N4O3/c26-21-8-7-14(13-20(21)25(27)28)15-11-18(16-5-1-3-9-22-16)24-19(12-15)17-6-2-4-10-23-17/h1-13,24H