5-azanyl-4-methoxy-2-methyl-benzenesulfonic acid

Systemtic Name: 5-azanyl-4-methoxy-2-methyl-benzenesulfonic acid Openeye Name: 5-amino-4-methoxy-2-methyl-benzenesulfonic acid CAS Name: 5-amino-4-methoxy-2-methylbenzenesulfonic acid IUPAC Name: 5-amino-4-methoxy-2-methylbenzenesulfonic acid Traditional Name: 5-amino-4-methoxy-2-methyl-besylic acid Formula: C8H11NO4S MolecularWeight: 217.24224

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1S(=O)(=O)O)N)OC

Isomeric SMILES

CC1=CC(=C(C=C1S(=O)(=O)O)N)OC

InChI

InChI=1S/C8H11NO4S/c1-5-3-7(13-2)6(9)4-8(5)14(10,11)12/h3-4H,9H2,1-2H3,(H,10,11,12)