1-[(4-dimethylaminophenyl)-(3-methylpyridin-2-yl)methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(4-dimethylaminophenyl)-(3-methylpyridin-2-yl)methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(4-dimethylaminophenyl)-(3-methyl-2-pyridyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(4-dimethylaminophenyl)-(3-methyl-2-pyridinyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(4-dimethylaminophenyl)-(3-methylpyridin-2-yl)methyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(4-dimethylaminophenyl)-(3-methyl-2-pyridyl)methyl]proline Formula: C20H25N3O2 MolecularWeight: 339.4314

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25N3O2/c1-14-6-4-12-21-18(14)19(23-13-5-7-17(23)20(24)25)15-8-10-16(11-9-15)22(2)3/h4,6,8-12,17,19H,5,7,13H2,1-3H3,(H,24,25)