methyl N-[[(E)-(3-nitro-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]amino]carbamate

Systemtic Name: methyl N-[[(E)-(3-nitro-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]amino]carbamate Openeye Name: methyl N-[[(E)-(3-nitro-4-oxo-cyclohexa-2,5-dien-1-ylidene)methyl]amino]carbamate CAS Name: N-[[(E)-(3-nitro-4-oxo-1-cyclohexa-2,5-dienylidene)methyl]amino]carbamic acid methyl ester IUPAC Name: methyl N-[[(E)-(3-nitro-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]amino]carbamate Traditional Name: N-[[(E)-(4-keto-3-nitro-cyclohexa-2,5-dien-1-ylidene)methyl]amino]carbamic acid methyl ester Formula: C9H9N3O5 MolecularWeight: 239.18486

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NNC=C1C=CC(=O)C(=C1)[N+](=O)[O-]

Isomeric SMILES

COC(=O)NN/C=C/1\C=CC(=O)C(=C1)[N+](=O)[O-]

InChI

InChI=1S/C9H9N3O5/c1-17-9(14)11-10-5-6-2-3-8(13)7(4-6)12(15)16/h2-5,10H,1H3,(H,11,14)/b6-5+