[3-(dimethylamino)-1-phenyl-propyl] 1-(4-methylphenyl)sulfonylpyrrolidine-2-carboxylate

Systemtic Name: [3-(dimethylamino)-1-phenyl-propyl] 1-(4-methylphenyl)sulfonylpyrrolidine-2-carboxylate Openeye Name: [3-(dimethylamino)-1-phenyl-propyl] 1-(p-tolylsulfonyl)pyrrolidine-2-carboxylate CAS Name: 1-(4-methylphenyl)sulfonyl-2-pyrrolidinecarboxylic acid [3-(dimethylamino)-1-phenylpropyl] ester IUPAC Name: [3-(dimethylamino)-1-phenylpropyl] 1-(4-methylphenyl)sulfonylpyrrolidine-2-carboxylate Traditional Name: 1-tosylpyrrolidine-2-carboxylic acid [3-(dimethylamino)-1-phenyl-propyl] ester Formula: C23H30N2O4S MolecularWeight: 430.5603

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)OC(CCN(C)C)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)OC(CCN(C)C)C3=CC=CC=C3

InChI

InChI=1S/C23H30N2O4S/c1-18-11-13-20(14-12-18)30(27,28)25-16-7-10-21(25)23(26)29-22(15-17-24(2)3)19-8-5-4-6-9-19/h4-6,8-9,11-14,21-22H,7,10,15-17H2,1-3H3