1-(diphenylmethyl)-2-methyl-azetidin-3-ol; 4-methylbenzenesulfonic acid

Systemtic Name: 1-(diphenylmethyl)-2-methyl-azetidin-3-ol; 4-methylbenzenesulfonic acid Openeye Name: 1-benzhydryl-2-methyl-azetidin-3-ol; 4-methylbenzenesulfonic acid CAS Name: 1-(diphenylmethyl)-2-methyl-3-azetidinol; 4-methylbenzenesulfonic acid IUPAC Name: 1-benzhydryl-2-methylazetidin-3-ol; 4-methylbenzenesulfonic acid Traditional Name: 1-benzhydryl-2-methyl-azetidin-3-ol; tosylic acid Formula: C24H27NO4S MolecularWeight: 425.54048

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(CN1C(C2=CC=CC=C2)C3=CC=CC=C3)O.CC1=CC=C(C=C1)S(=O)(=O)O

Isomeric SMILES

CC1C(CN1C(C2=CC=CC=C2)C3=CC=CC=C3)O.CC1=CC=C(C=C1)S(=O)(=O)O

InChI

InChI=1S/C17H19NO.C7H8O3S/c1-13-16(19)12-18(13)17(14-8-4-2-5-9-14)15-10-6-3-7-11-15;1-6-2-4-7(5-3-6)11(8,9)10/h2-11,13,16-17,19H,12H2,1H3;2-5H,1H3,(H,8,9,10)