5-azanylidene-2,3-bis(chloranyl)-1-sulfo-cyclohex-2-ene-1-carboxylic acid

Systemtic Name: 5-azanylidene-2,3-bis(chloranyl)-1-sulfo-cyclohex-2-ene-1-carboxylic acid Openeye Name: 2,3-dichloro-5-imino-1-sulfo-cyclohex-2-ene-1-carboxylic acid CAS Name: 2,3-dichloro-5-imino-1-sulfo-1-cyclohex-2-enecarboxylic acid IUPAC Name: 2,3-dichloro-5-imino-1-sulfocyclohex-2-ene-1-carboxylic acid Traditional Name: 2,3-dichloro-5-imino-1-sulfo-cyclohex-2-ene-1-carboxylic acid Formula: C7H7Cl2NO5S MolecularWeight: 288.10518

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(=N)CC(C(=C1Cl)Cl)(C(=O)O)S(=O)(=O)O

Isomeric SMILES

C1C(=N)CC(C(=C1Cl)Cl)(C(=O)O)S(=O)(=O)O

InChI

InChI=1S/C7H7Cl2NO5S/c8-4-1-3(10)2-7(5(4)9,6(11)12)16(13,14)15/h10H,1-2H2,(H,11,12)(H,13,14,15)