2-azanyl-4-methyl-3-oxidanyl-benzenesulfonate

Systemtic Name: 2-azanyl-4-methyl-3-oxidanyl-benzenesulfonate Openeye Name: 2-amino-3-hydroxy-4-methyl-benzenesulfonate CAS Name: 2-amino-3-hydroxy-4-methylbenzenesulfonate IUPAC Name: 2-amino-3-hydroxy-4-methylbenzenesulfonate Traditional Name: 2-amino-3-hydroxy-4-methyl-besylate Formula: C7H8NO4S- MolecularWeight: 202.20772

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)S(=O)(=O)[O-])N)O

Isomeric SMILES

CC1=C(C(=C(C=C1)S(=O)(=O)[O-])N)O

InChI

InChI=1S/C7H9NO4S/c1-4-2-3-5(13(10,11)12)6(8)7(4)9/h2-3,9H,8H2,1H3,(H,10,11,12)/p-1