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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22N2O2/c1-13-7-8-16(14(2)11-13)18(15-5-3-9-20-12-15)21-10-4-6-17(21)19(22)23/h3,5,7-9,11-12,17-18H,4,6,10H2,1-2H3,(H,22,23)