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1-(diphenylmethyl)piperidin-3-ol; 4-methylbenzenesulfonic acid

1-(diphenylmethyl)piperidin-3-ol; 4-methylbenzenesulfonic acid

Systemtic Name:1-(diphenylmethyl)piperidin-3-ol; 4-methylbenzenesulfonic acid
Openeye Name:1-benzhydrylpiperidin-3-ol; 4-methylbenzenesulfonic acid
CAS Name:1-(diphenylmethyl)-3-piperidinol; 4-methylbenzenesulfonic acid
IUPAC Name:1-benzhydrylpiperidin-3-ol; 4-methylbenzenesulfonic acid
Traditional Name:1-benzhydrylpiperidin-3-ol; tosylic acid
Formula: C25H29NO4S
MolecularWeight: 439.56706
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)O.C1CC(CN(C1)C(C2=CC=CC=C2)C3=CC=CC=C3)O


Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O.C1CC(CN(C1)C(C2=CC=CC=C2)C3=CC=CC=C3)O


InChI

InChI=1S/C18H21NO.C7H8O3S/c20-17-12-7-13-19(14-17)18(15-8-3-1-4-9-15)16-10-5-2-6-11-16;1-6-2-4-7(5-3-6)11(8,9)10/h1-6,8-11,17-18,20H,7,12-14H2;2-5H,1H3,(H,8,9,10)


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