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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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