4-methylbenzenesulfonic acid; 1-[4-(2-methylphenyl)cyclohexyl]piperidine

Systemtic Name: 4-methylbenzenesulfonic acid; 1-[4-(2-methylphenyl)cyclohexyl]piperidine Openeye Name: 4-methylbenzenesulfonic acid; 1-[4-(o-tolyl)cyclohexyl]piperidine CAS Name: 4-methylbenzenesulfonic acid; 1-[4-(2-methylphenyl)cyclohexyl]piperidine IUPAC Name: 4-methylbenzenesulfonic acid; 1-[4-(2-methylphenyl)cyclohexyl]piperidine Traditional Name: 1-[4-(o-tolyl)cyclohexyl]piperidine; tosylic acid Formula: C25H35NO3S MolecularWeight: 429.6153

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)O.CC1=CC=CC=C1C2CCC(CC2)N3CCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O.CC1=CC=CC=C1C2CCC(CC2)N3CCCCC3

InChI

InChI=1S/C18H27N.C7H8O3S/c1-15-7-3-4-8-18(15)16-9-11-17(12-10-16)19-13-5-2-6-14-19;1-6-2-4-7(5-3-6)11(8,9)10/h3-4,7-8,16-17H,2,5-6,9-14H2,1H3;2-5H,1H3,(H,8,9,10)