sodium 4-azanyl-5-methoxy-2-methyl-benzenesulfonate

Systemtic Name: sodium 4-azanyl-5-methoxy-2-methyl-benzenesulfonate Openeye Name: sodium 4-amino-5-methoxy-2-methyl-benzenesulfonate CAS Name: sodium 4-amino-5-methoxy-2-methylbenzenesulfonate IUPAC Name: sodium 4-amino-5-methoxy-2-methylbenzenesulfonate Traditional Name: sodium 4-amino-5-methoxy-2-methyl-besylate Formula: C8H10NNaO4S MolecularWeight: 239.22407

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1S(=O)(=O)[O-])OC)N.[Na+]

Isomeric SMILES

CC1=CC(=C(C=C1S(=O)(=O)[O-])OC)N.[Na+]

InChI

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