5-azanylidene-2-nitro-1-sulfo-cyclohex-2-ene-1-carboxylic acid

Systemtic Name: 5-azanylidene-2-nitro-1-sulfo-cyclohex-2-ene-1-carboxylic acid Openeye Name: 5-imino-2-nitro-1-sulfo-cyclohex-2-ene-1-carboxylic acid CAS Name: 5-imino-2-nitro-1-sulfo-1-cyclohex-2-enecarboxylic acid IUPAC Name: 5-imino-2-nitro-1-sulfocyclohex-2-ene-1-carboxylic acid Traditional Name: 5-imino-2-nitro-1-sulfo-cyclohex-2-ene-1-carboxylic acid Formula: C7H8N2O7S MolecularWeight: 264.21262

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Descriptors Computed from Structure

Canonical SMILES:

C1C=C(C(CC1=N)(C(=O)O)S(=O)(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1C=C(C(CC1=N)(C(=O)O)S(=O)(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C7H8N2O7S/c8-4-1-2-5(9(12)13)7(3-4,6(10)11)17(14,15)16/h2,8H,1,3H2,(H,10,11)(H,14,15,16)