(E)-4-azanylbut-2-en-1-ol; 4-methylbenzenesulfonic acid

Systemtic Name: (E)-4-azanylbut-2-en-1-ol; 4-methylbenzenesulfonic acid Openeye Name: (E)-4-aminobut-2-en-1-ol; 4-methylbenzenesulfonic acid CAS Name: (E)-4-amino-2-buten-1-ol; 4-methylbenzenesulfonic acid IUPAC Name: (E)-4-aminobut-2-en-1-ol; 4-methylbenzenesulfonic acid Traditional Name: (E)-4-aminobut-2-en-1-ol; tosylic acid Formula: C11H17NO4S MolecularWeight: 259.32198

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)O.C(C=CCO)N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O.C(/C=C/CO)N

InChI

InChI=1S/C7H8O3S.C4H9NO/c1-6-2-4-7(5-3-6)11(8,9)10;5-3-1-2-4-6/h2-5H,1H3,(H,8,9,10);1-2,6H,3-5H2/b;2-1+