1-[(5-methylpyridin-2-yl)-(2,4,5-trimethoxyphenyl)methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(5-methylpyridin-2-yl)-(2,4,5-trimethoxyphenyl)methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(5-methyl-2-pyridyl)-(2,4,5-trimethoxyphenyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(5-methyl-2-pyridinyl)-(2,4,5-trimethoxyphenyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(5-methylpyridin-2-yl)-(2,4,5-trimethoxyphenyl)methyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[asaryl-(5-methyl-2-pyridyl)methyl]proline Formula: C21H26N2O5 MolecularWeight: 386.44154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C=C1)C(C2=CC(=C(C=C2OC)OC)OC)N3CCCC3C(=O)O

Isomeric SMILES

CC1=CN=C(C=C1)C(C2=CC(=C(C=C2OC)OC)OC)N3CCCC3C(=O)O

InChI

InChI=1S/C21H26N2O5/c1-13-7-8-15(22-12-13)20(23-9-5-6-16(23)21(24)25)14-10-18(27-3)19(28-4)11-17(14)26-2/h7-8,10-12,16,20H,5-6,9H2,1-4H3,(H,24,25)