1-[(3,5-dimethylphenyl)-pyridin-4-yl-methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(3,5-dimethylphenyl)-pyridin-4-yl-methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(3,5-dimethylphenyl)-(4-pyridyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(3,5-dimethylphenyl)-pyridin-4-ylmethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(3,5-dimethylphenyl)-pyridin-4-ylmethyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(3,5-dimethylphenyl)-(4-pyridyl)methyl]proline Formula: C19H22N2O2 MolecularWeight: 310.39018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(C2=CC=NC=C2)N3CCCC3C(=O)O)C

Isomeric SMILES

CC1=CC(=CC(=C1)C(C2=CC=NC=C2)N3CCCC3C(=O)O)C

InChI

InChI=1S/C19H22N2O2/c1-13-10-14(2)12-16(11-13)18(15-5-7-20-8-6-15)21-9-3-4-17(21)19(22)23/h5-8,10-12,17-18H,3-4,9H2,1-2H3,(H,22,23)