4-(2,6-dimethylpiperidin-1-yl)-1,1-diphenyl-butan-1-ol; 4-methylbenzenesulfonic acid

Systemtic Name: 4-(2,6-dimethylpiperidin-1-yl)-1,1-diphenyl-butan-1-ol; 4-methylbenzenesulfonic acid Openeye Name: 4-(2,6-dimethyl-1-piperidyl)-1,1-diphenyl-butan-1-ol; 4-methylbenzenesulfonic acid CAS Name: 4-(2,6-dimethyl-1-piperidinyl)-1,1-diphenyl-1-butanol; 4-methylbenzenesulfonic acid IUPAC Name: 4-(2,6-dimethylpiperidin-1-yl)-1,1-diphenylbutan-1-ol; 4-methylbenzenesulfonic acid Traditional Name: 4-(2,6-dimethylpiperidino)-1,1-diphenyl-butan-1-ol; tosylic acid Formula: C30H39NO4S MolecularWeight: 509.69996

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1CCCC(C2=CC=CC=C2)(C3=CC=CC=C3)O)C.CC1=CC=C(C=C1)S(=O)(=O)O

Isomeric SMILES

CC1CCCC(N1CCCC(C2=CC=CC=C2)(C3=CC=CC=C3)O)C.CC1=CC=C(C=C1)S(=O)(=O)O

InChI

InChI=1S/C23H31NO.C7H8O3S/c1-19-11-9-12-20(2)24(19)18-10-17-23(25,21-13-5-3-6-14-21)22-15-7-4-8-16-22;1-6-2-4-7(5-3-6)11(8,9)10/h3-8,13-16,19-20,25H,9-12,17-18H2,1-2H3;2-5H,1H3,(H,8,9,10)