6-azanyl-6-sulfo-cyclohexa-2,4-diene-1-carboxylic acid

Systemtic Name: 6-azanyl-6-sulfo-cyclohexa-2,4-diene-1-carboxylic acid Openeye Name: 6-amino-6-sulfo-cyclohexa-2,4-diene-1-carboxylic acid CAS Name: 6-amino-6-sulfo-1-cyclohexa-2,4-dienecarboxylic acid IUPAC Name: 6-amino-6-sulfocyclohexa-2,4-diene-1-carboxylic acid Traditional Name: 6-amino-6-sulfo-cyclohexa-2,4-diene-1-carboxylic acid Formula: C7H9NO5S MolecularWeight: 219.21506

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(C(C=C1)(N)S(=O)(=O)O)C(=O)O

Isomeric SMILES

C1=CC(C(C=C1)(N)S(=O)(=O)O)C(=O)O

InChI

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