(2S)-N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(4-methylphenyl)sulfonyl-pyrrolidine-2-carboxamide

Systemtic Name: (2S)-N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(4-methylphenyl)sulfonyl-pyrrolidine-2-carboxamide Openeye Name: (2S)-N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(p-tolylsulfonyl)pyrrolidine-2-carboxamide CAS Name: (2S)-N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(4-methylphenyl)sulfonyl-2-pyrrolidinecarboxamide IUPAC Name: (2S)-N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(4-methylphenyl)sulfonylpyrrolidine-2-carboxamide Traditional Name: (2S)-N-homoveratryl-1-tosyl-pyrrolidine-2-carboxamide Formula: C22H28N2O5S MolecularWeight: 432.53312

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)NCCC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC[C@H]2C(=O)NCCC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C22H28N2O5S/c1-16-6-9-18(10-7-16)30(26,27)24-14-4-5-19(24)22(25)23-13-12-17-8-11-20(28-2)21(15-17)29-3/h6-11,15,19H,4-5,12-14H2,1-3H3,(H,23,25)/t19-/m0/s1