4-azanyl-2-cyano-benzenesulfonic acid

Systemtic Name: 4-azanyl-2-cyano-benzenesulfonic acid Openeye Name: 4-amino-2-cyano-benzenesulfonic acid CAS Name: 4-amino-2-cyanobenzenesulfonic acid IUPAC Name: 4-amino-2-cyanobenzenesulfonic acid Traditional Name: 4-amino-2-cyano-besylic acid Formula: C7H6N2O3S MolecularWeight: 198.19914

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1N)C#N)S(=O)(=O)O

Isomeric SMILES

C1=CC(=C(C=C1N)C#N)S(=O)(=O)O

InChI

InChI=1S/C7H6N2O3S/c8-4-5-3-6(9)1-2-7(5)13(10,11)12/h1-3H,9H2,(H,10,11,12)