1-[bis(5-methylpyridin-2-yl)methyl]pyrrolidine-2-carboxylic acid

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21N3O2/c1-12-5-7-14(19-10-12)17(15-8-6-13(2)11-20-15)21-9-3-4-16(21)18(22)23/h5-8,10-11,16-17H,3-4,9H2,1-2H3,(H,22,23)