1-[(3-methylpyridin-2-yl)-(3,4,5-trimethoxyphenyl)methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(3-methylpyridin-2-yl)-(3,4,5-trimethoxyphenyl)methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(3-methyl-2-pyridyl)-(3,4,5-trimethoxyphenyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(3-methyl-2-pyridinyl)-(3,4,5-trimethoxyphenyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(3-methylpyridin-2-yl)-(3,4,5-trimethoxyphenyl)methyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(3-methyl-2-pyridyl)-(3,4,5-trimethoxyphenyl)methyl]proline Formula: C21H26N2O5 MolecularWeight: 386.44154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26N2O5/c1-13-7-5-9-22-18(13)19(23-10-6-8-15(23)21(24)25)14-11-16(26-2)20(28-4)17(12-14)27-3/h5,7,9,11-12,15,19H,6,8,10H2,1-4H3,(H,24,25)