4-methylbenzenesulfonic acid; prop-2-en-1-amine

Systemtic Name: 4-methylbenzenesulfonic acid; prop-2-en-1-amine Openeye Name: 4-methylbenzenesulfonic acid; prop-2-en-1-amine CAS Name: 4-methylbenzenesulfonic acid; 2-propen-1-amine IUPAC Name: 4-methylbenzenesulfonic acid; prop-2-en-1-amine Traditional Name: allylamine; tosylic acid Formula: C10H15NO3S MolecularWeight: 229.296

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H8O3S.C3H7N/c1-6-2-4-7(5-3-6)11(8,9)10;1-2-3-4/h2-5H,1H3,(H,8,9,10);2H,1,3-4H2