4-methylbenzenesulfonic acid; piperazine

Systemtic Name: 4-methylbenzenesulfonic acid; piperazine Openeye Name: 4-methylbenzenesulfonic acid; piperazine CAS Name: 4-methylbenzenesulfonic acid; piperazine IUPAC Name: 4-methylbenzenesulfonic acid; piperazine Traditional Name: piperazine; tosylic acid Formula: C18H26N2O6S2 MolecularWeight: 430.53884

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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.C1CNCCN1

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O.CC1=CC=C(C=C1)S(=O)(=O)O.C1CNCCN1

InChI

InChI=1S/2C7H8O3S.C4H10N2/c2*1-6-2-4-7(5-3-6)11(8,9)10;1-2-6-4-3-5-1/h2*2-5H,1H3,(H,8,9,10);5-6H,1-4H2