(4Z)-2-nitro-4-(2-phenylazanyl-1H-pyrimidin-6-ylidene)cyclohexa-2,5-dien-1-one

Systemtic Name: (4Z)-2-nitro-4-(2-phenylazanyl-1H-pyrimidin-6-ylidene)cyclohexa-2,5-dien-1-one Openeye Name: (4Z)-4-(2-anilino-1H-pyrimidin-6-ylidene)-2-nitro-cyclohexa-2,5-dien-1-one CAS Name: (4Z)-4-(2-anilino-1H-pyrimidin-6-ylidene)-2-nitro-1-cyclohexa-2,5-dienone IUPAC Name: (4Z)-4-(2-anilino-1H-pyrimidin-6-ylidene)-2-nitrocyclohexa-2,5-dien-1-one Traditional Name: (4Z)-4-(2-anilino-1H-pyrimidin-6-ylidene)-2-nitro-cyclohexa-2,5-dien-1-one Formula: C16H12N4O3 MolecularWeight: 308.29148

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NC=CC(=C3C=CC(=O)C(=C3)[N+](=O)[O-])N2

Isomeric SMILES

C1=CC=C(C=C1)NC2=NC=C/C(=C/3\C=CC(=O)C(=C3)[N+](=O)[O-])/N2

InChI

InChI=1S/C16H12N4O3/c21-15-7-6-11(10-14(15)20(22)23)13-8-9-17-16(19-13)18-12-4-2-1-3-5-12/h1-10H,(H2,17,18,19)/b13-11-