3-nitro-5-[oxidanyl(1H-pyridin-4-ylidene)methyl]cyclohexa-3,5-diene-1,2-dione

Systemtic Name: 3-nitro-5-[oxidanyl(1H-pyridin-4-ylidene)methyl]cyclohexa-3,5-diene-1,2-dione Openeye Name: 5-[hydroxy(1H-pyridin-4-ylidene)methyl]-3-nitro-1,2-benzoquinone CAS Name: 5-[hydroxy(1H-pyridin-4-ylidene)methyl]-3-nitrocyclohexa-3,5-diene-1,2-dione IUPAC Name: 5-[hydroxy(1H-pyridin-4-ylidene)methyl]-3-nitrocyclohexa-3,5-diene-1,2-dione Traditional Name: 5-[hydroxy(1H-pyridin-4-ylidene)methyl]-3-nitro-o-benzoquinone Formula: C12H8N2O5 MolecularWeight: 260.20232

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Descriptors Computed from Structure

Canonical SMILES:

C1=CNC=CC1=C(C2=CC(=O)C(=O)C(=C2)[N+](=O)[O-])O

Isomeric SMILES

C1=CNC=CC1=C(C2=CC(=O)C(=O)C(=C2)[N+](=O)[O-])O

InChI

InChI=1S/C12H8N2O5/c15-10-6-8(5-9(12(10)17)14(18)19)11(16)7-1-3-13-4-2-7/h1-6,13,16H