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

Systemtic Name: 5-azanylidene-1-sulfo-cyclohex-2-ene-1-carboxylic acid Openeye Name: 5-imino-1-sulfo-cyclohex-2-ene-1-carboxylic acid CAS Name: 5-imino-1-sulfo-1-cyclohex-2-enecarboxylic acid IUPAC Name: 5-imino-1-sulfocyclohex-2-ene-1-carboxylic acid Traditional Name: 5-imino-1-sulfo-cyclohex-2-ene-1-carboxylic acid Formula: C7H9NO5S MolecularWeight: 219.21506

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CC(CC1=N)(C(=O)O)S(=O)(=O)O

Isomeric SMILES

C1C=CC(CC1=N)(C(=O)O)S(=O)(=O)O

InChI

InChI=1S/C7H9NO5S/c8-5-2-1-3-7(4-5,6(9)10)14(11,12)13/h1,3,8H,2,4H2,(H,9,10)(H,11,12,13)