5-azanyl-2-chloranyl-4-sulfo-benzoic acid

Systemtic Name: 5-azanyl-2-chloranyl-4-sulfo-benzoic acid Openeye Name: 5-amino-2-chloro-4-sulfo-benzoic acid CAS Name: 5-amino-2-chloro-4-sulfobenzoic acid IUPAC Name: 5-amino-2-chloro-4-sulfobenzoic acid Traditional Name: 5-amino-2-chloro-4-sulfo-benzoic acid Formula: C7H6ClNO5S MolecularWeight: 251.64424

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=CC(=C1N)S(=O)(=O)O)Cl)C(=O)O

Isomeric SMILES

C1=C(C(=CC(=C1N)S(=O)(=O)O)Cl)C(=O)O

InChI

InChI=1S/C7H6ClNO5S/c8-4-2-6(15(12,13)14)5(9)1-3(4)7(10)11/h1-2H,9H2,(H,10,11)(H,12,13,14)