1-[(5-ethylpyridin-2-yl)-pyridin-3-yl-methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(5-ethylpyridin-2-yl)-pyridin-3-yl-methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(5-ethyl-2-pyridyl)-(3-pyridyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(5-ethyl-2-pyridinyl)-(3-pyridinyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(5-ethylpyridin-2-yl)-pyridin-3-ylmethyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(5-ethyl-2-pyridyl)-(3-pyridyl)methyl]proline Formula: C18H21N3O2 MolecularWeight: 311.37824

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CN=C(C=C1)C(C2=CN=CC=C2)N3CCCC3C(=O)O

Isomeric SMILES

CCC1=CN=C(C=C1)C(C2=CN=CC=C2)N3CCCC3C(=O)O

InChI

InChI=1S/C18H21N3O2/c1-2-13-7-8-15(20-11-13)17(14-5-3-9-19-12-14)21-10-4-6-16(21)18(22)23/h3,5,7-9,11-12,16-17H,2,4,6,10H2,1H3,(H,22,23)