4-methylbenzenesulfonic acid; piperidin-1-amine

Systemtic Name: 4-methylbenzenesulfonic acid; piperidin-1-amine Openeye Name: 4-methylbenzenesulfonic acid; piperidin-1-amine CAS Name: 4-methylbenzenesulfonic acid; 1-piperidinamine IUPAC Name: 4-methylbenzenesulfonic acid; piperidin-1-amine Traditional Name: piperidinoamine; tosylic acid Formula: C19H28N2O6S2 MolecularWeight: 444.56542

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)O.CC1=CC=C(C=C1)S(=O)(=O)O.C1CCN(CC1)N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O.CC1=CC=C(C=C1)S(=O)(=O)O.C1CCN(CC1)N

InChI

InChI=1S/2C7H8O3S.C5H12N2/c2*1-6-2-4-7(5-3-6)11(8,9)10;6-7-4-2-1-3-5-7/h2*2-5H,1H3,(H,8,9,10);1-6H2