[(2-methoxy-5-methyl-phenyl)amino]methanesulfonic acid

Systemtic Name: [(2-methoxy-5-methyl-phenyl)amino]methanesulfonic acid Openeye Name: (2-methoxy-5-methyl-anilino)methanesulfonic acid CAS Name: (2-methoxy-5-methylanilino)methanesulfonic acid IUPAC Name: (2-methoxy-5-methylanilino)methanesulfonic acid Traditional Name: (2-methoxy-5-methyl-anilino)methanesulfonic acid Formula: C9H13NO4S MolecularWeight: 231.26882

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)NCS(=O)(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)OC)NCS(=O)(=O)O

InChI

InChI=1S/C9H13NO4S/c1-7-3-4-9(14-2)8(5-7)10-6-15(11,12)13/h3-5,10H,6H2,1-2H3,(H,11,12,13)