(8Z)-8-(3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-7,9-dihydro-3H-purin-6-one

Systemtic Name: (8Z)-8-(3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-7,9-dihydro-3H-purin-6-one Openeye Name: (8Z)-8-(3-nitro-6-oxo-cyclohexa-2,4-dien-1-ylidene)-7,9-dihydro-3H-purin-6-one CAS Name: (8Z)-8-(3-nitro-6-oxo-1-cyclohexa-2,4-dienylidene)-7,9-dihydro-3H-purin-6-one IUPAC Name: (8Z)-8-(3-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)-7,9-dihydro-3H-purin-6-one Traditional Name: (8Z)-8-(6-keto-3-nitro-cyclohexa-2,4-dien-1-ylidene)-7,9-dihydro-3H-purin-6-one Formula: C11H7N5O4 MolecularWeight: 273.20438

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=O)C(=C2NC3=C(N2)NC=NC3=O)C=C1[N+](=O)[O-]

Isomeric SMILES

C1=CC(=O)/C(=C\2/NC3=C(N2)NC=NC3=O)/C=C1[N+](=O)[O-]

InChI

InChI=1S/C11H7N5O4/c17-7-2-1-5(16(19)20)3-6(7)9-14-8-10(15-9)12-4-13-11(8)18/h1-4,14H,(H2,12,13,15,18)/b9-6-