(3R)-1-[(1R)-1-(3,4-dimethylphenyl)-2-piperidin-1-yl-ethyl]-5-oxidanylidene-pyrrolidine-3-carboxylic acid

Systemtic Name: (3R)-1-[(1R)-1-(3,4-dimethylphenyl)-2-piperidin-1-yl-ethyl]-5-oxidanylidene-pyrrolidine-3-carboxylic acid Openeye Name: (3R)-1-[(1R)-1-(3,4-dimethylphenyl)-2-(1-piperidyl)ethyl]-5-oxo-pyrrolidine-3-carboxylic acid CAS Name: (3R)-1-[(1R)-1-(3,4-dimethylphenyl)-2-(1-piperidinyl)ethyl]-5-oxo-3-pyrrolidinecarboxylic acid IUPAC Name: (3R)-1-[(1R)-1-(3,4-dimethylphenyl)-2-piperidin-1-ylethyl]-5-oxopyrrolidine-3-carboxylic acid Traditional Name: (3R)-1-[(1R)-1-(3,4-dimethylphenyl)-2-piperidino-ethyl]-5-keto-pyrrolidine-3-carboxylic acid Formula: C20H28N2O3 MolecularWeight: 344.44792

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(CN2CCCCC2)N3CC(CC3=O)C(=O)O)C

Isomeric SMILES

CC1=C(C=C(C=C1)[C@H](CN2CCCCC2)N3C[C@@H](CC3=O)C(=O)O)C

InChI

InChI=1S/C20H28N2O3/c1-14-6-7-16(10-15(14)2)18(13-21-8-4-3-5-9-21)22-12-17(20(24)25)11-19(22)23/h6-7,10,17-18H,3-5,8-9,11-13H2,1-2H3,(H,24,25)/t17-,18+/m1/s1