1-(3-azanyl-4-methyl-phenyl)-2-oxidanyl-ethanesulfinic acid

Systemtic Name: 1-(3-azanyl-4-methyl-phenyl)-2-oxidanyl-ethanesulfinic acid Openeye Name: 1-(3-amino-4-methyl-phenyl)-2-hydroxy-ethanesulfinic acid CAS Name: 1-(3-amino-4-methylphenyl)-2-hydroxyethanesulfinic acid IUPAC Name: 1-(3-amino-4-methylphenyl)-2-hydroxyethanesulfinic acid Traditional Name: 1-(3-amino-4-methyl-phenyl)-2-hydroxy-ethanesulfinic acid Formula: C9H13NO3S MolecularWeight: 215.26942

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(CO)S(=O)O)N

Isomeric SMILES

CC1=C(C=C(C=C1)C(CO)S(=O)O)N

InChI

InChI=1S/C9H13NO3S/c1-6-2-3-7(4-8(6)10)9(5-11)14(12)13/h2-4,9,11H,5,10H2,1H3,(H,12,13)