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

Systemtic Name: 2-azanyl-5-methoxy-benzenesulfonic acid; 4-azanyl-5-methoxy-2-methyl-benzenesulfonic acid Openeye Name: 2-amino-5-methoxy-benzenesulfonic acid; 4-amino-5-methoxy-2-methyl-benzenesulfonic acid CAS Name: 2-amino-5-methoxybenzenesulfonic acid; 4-amino-5-methoxy-2-methylbenzenesulfonic acid IUPAC Name: 2-amino-5-methoxybenzenesulfonic acid; 4-amino-5-methoxy-2-methylbenzenesulfonic acid Traditional Name: 2-amino-5-methoxy-besylic acid; 4-amino-5-methoxy-2-methyl-besylic acid Formula: C15H20N2O8S2 MolecularWeight: 420.4579

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1S(=O)(=O)O)OC)N.COC1=CC(=C(C=C1)N)S(=O)(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1S(=O)(=O)O)OC)N.COC1=CC(=C(C=C1)N)S(=O)(=O)O

InChI

InChI=1S/C8H11NO4S.C7H9NO4S/c1-5-3-6(9)7(13-2)4-8(5)14(10,11)12;1-12-5-2-3-6(8)7(4-5)13(9,10)11/h3-4H,9H2,1-2H3,(H,10,11,12);2-4H,8H2,1H3,(H,9,10,11)