4-methylbenzenesulfonic acid; 4-methyl-1-(triphenylmethyl)pyrrolidin-3-ol

Systemtic Name: 4-methylbenzenesulfonic acid; 4-methyl-1-(triphenylmethyl)pyrrolidin-3-ol Openeye Name: 4-methylbenzenesulfonic acid; 4-methyl-1-trityl-pyrrolidin-3-ol CAS Name: 4-methylbenzenesulfonic acid; 4-methyl-1-(triphenylmethyl)-3-pyrrolidinol IUPAC Name: 4-methylbenzenesulfonic acid; 4-methyl-1-tritylpyrrolidin-3-ol Traditional Name: 4-methyl-1-trityl-pyrrolidin-3-ol; tosylic acid Formula: C31H33NO4S MolecularWeight: 515.66302

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC1O)C(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.CC1=CC=C(C=C1)S(=O)(=O)O

Isomeric SMILES

CC1CN(CC1O)C(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.CC1=CC=C(C=C1)S(=O)(=O)O

InChI

InChI=1S/C24H25NO.C7H8O3S/c1-19-17-25(18-23(19)26)24(20-11-5-2-6-12-20,21-13-7-3-8-14-21)22-15-9-4-10-16-22;1-6-2-4-7(5-3-6)11(8,9)10/h2-16,19,23,26H,17-18H2,1H3;2-5H,1H3,(H,8,9,10)