1-(diphenylmethyl)aziridin-2-ol; 4-methylbenzenesulfonic acid

Systemtic Name: 1-(diphenylmethyl)aziridin-2-ol; 4-methylbenzenesulfonic acid Openeye Name: 1-benzhydrylaziridin-2-ol; 4-methylbenzenesulfonic acid CAS Name: 1-(diphenylmethyl)-2-aziridinol; 4-methylbenzenesulfonic acid IUPAC Name: 1-benzhydrylaziridin-2-ol; 4-methylbenzenesulfonic acid Traditional Name: 1-benzhydrylethylenimin-2-ol; tosylic acid Formula: C22H23NO4S MolecularWeight: 397.48732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)O.C1C(N1C(C2=CC=CC=C2)C3=CC=CC=C3)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O.C1C(N1C(C2=CC=CC=C2)C3=CC=CC=C3)O

InChI

InChI=1S/C15H15NO.C7H8O3S/c17-14-11-16(14)15(12-7-3-1-4-8-12)13-9-5-2-6-10-13;1-6-2-4-7(5-3-6)11(8,9)10/h1-10,14-15,17H,11H2;2-5H,1H3,(H,8,9,10)