4-(aminomethyl)benzene-1,2-diol; 4-methylbenzenesulfonic acid

Systemtic Name: 4-(aminomethyl)benzene-1,2-diol; 4-methylbenzenesulfonic acid Openeye Name: 4-(aminomethyl)benzene-1,2-diol; 4-methylbenzenesulfonic acid CAS Name: 4-(aminomethyl)benzene-1,2-diol; 4-methylbenzenesulfonic acid IUPAC Name: 4-(aminomethyl)benzene-1,2-diol; 4-methylbenzenesulfonic acid Traditional Name: 4-(aminomethyl)pyrocatechol; tosylic acid Formula: C14H17NO5S MolecularWeight: 311.35348

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)O.C1=CC(=C(C=C1CN)O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O.C1=CC(=C(C=C1CN)O)O

InChI

InChI=1S/C7H9NO2.C7H8O3S/c8-4-5-1-2-6(9)7(10)3-5;1-6-2-4-7(5-3-6)11(8,9)10/h1-3,9-10H,4,8H2;2-5H,1H3,(H,8,9,10)