2-[[(Z)-(3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]amino]ethyl hydrogen sulfate

Systemtic Name: 2-[[(Z)-(3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]amino]ethyl hydrogen sulfate Openeye Name: 2-[[(Z)-(3-nitro-6-oxo-cyclohexa-2,4-dien-1-ylidene)methyl]amino]ethyl hydrogen sulfate CAS Name: sulfuric acid 2-[[(Z)-(3-nitro-6-oxo-1-cyclohexa-2,4-dienylidene)methyl]amino]ethyl ester IUPAC Name: 2-[[(Z)-(3-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]ethyl hydrogen sulfate Traditional Name: sulfuric acid 2-[[(Z)-(6-keto-3-nitro-cyclohexa-2,4-dien-1-ylidene)methyl]amino]ethyl ester Formula: C9H10N2O7S MolecularWeight: 290.2499

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=O)C(=CNCCOS(=O)(=O)O)C=C1[N+](=O)[O-]

Isomeric SMILES

C1=CC(=O)/C(=C\NCCOS(=O)(=O)O)/C=C1[N+](=O)[O-]

InChI

InChI=1S/C9H10N2O7S/c12-9-2-1-8(11(13)14)5-7(9)6-10-3-4-18-19(15,16)17/h1-2,5-6,10H,3-4H2,(H,15,16,17)/b7-6-