4-[[2-(6-azanyl-5-nitro-pyrimidin-4-yl)hydrazinyl]methylidene]-2-methoxy-cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[[2-(6-azanyl-5-nitro-pyrimidin-4-yl)hydrazinyl]methylidene]-2-methoxy-cyclohexa-2,5-dien-1-one Openeye Name: 4-[[2-(6-amino-5-nitro-pyrimidin-4-yl)hydrazino]methylene]-2-methoxy-cyclohexa-2,5-dien-1-one CAS Name: 4-[[(6-amino-5-nitro-4-pyrimidinyl)hydrazo]methylidene]-2-methoxy-1-cyclohexa-2,5-dienone IUPAC Name: 4-[[2-(6-amino-5-nitropyrimidin-4-yl)hydrazinyl]methylidene]-2-methoxycyclohexa-2,5-dien-1-one Traditional Name: 4-[[N'-(6-amino-5-nitro-pyrimidin-4-yl)hydrazino]methylene]-2-methoxy-cyclohexa-2,5-dien-1-one Formula: C12H12N6O4 MolecularWeight: 304.26148

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CNNC2=NC=NC(=C2[N+](=O)[O-])N)C=CC1=O

Isomeric SMILES

COC1=CC(=CNNC2=NC=NC(=C2[N+](=O)[O-])N)C=CC1=O

InChI

InChI=1S/C12H12N6O4/c1-22-9-4-7(2-3-8(9)19)5-16-17-12-10(18(20)21)11(13)14-6-15-12/h2-6,16H,1H3,(H3,13,14,15,17)