[1-(diphenylmethyl)pyrrolidin-3-yl] 4-methylbenzenesulfonate

Systemtic Name: [1-(diphenylmethyl)pyrrolidin-3-yl] 4-methylbenzenesulfonate Openeye Name: (1-benzhydrylpyrrolidin-3-yl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [1-(diphenylmethyl)-3-pyrrolidinyl] ester IUPAC Name: (1-benzhydrylpyrrolidin-3-yl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (1-benzhydrylpyrrolidin-3-yl) ester Formula: C24H25NO3S MolecularWeight: 407.5252

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2CCN(C2)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2CCN(C2)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C24H25NO3S/c1-19-12-14-23(15-13-19)29(26,27)28-22-16-17-25(18-22)24(20-8-4-2-5-9-20)21-10-6-3-7-11-21/h2-15,22,24H,16-18H2,1H3