1-[(3,4-diethoxyphenyl)-naphthalen-1-yl-methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(3,4-diethoxyphenyl)-naphthalen-1-yl-methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(3,4-diethoxyphenyl)-(1-naphthyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(3,4-diethoxyphenyl)-(1-naphthalenyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(3,4-diethoxyphenyl)-naphthalen-1-ylmethyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(3,4-diethoxyphenyl)-(1-naphthyl)methyl]proline Formula: C26H29NO4 MolecularWeight: 419.51276

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(C2=CC=CC3=CC=CC=C32)N4CCCC4C(=O)O)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(C2=CC=CC3=CC=CC=C32)N4CCCC4C(=O)O)OCC

InChI

InChI=1S/C26H29NO4/c1-3-30-23-15-14-19(17-24(23)31-4-2)25(27-16-8-13-22(27)26(28)29)21-12-7-10-18-9-5-6-11-20(18)21/h5-7,9-12,14-15,17,22,25H,3-4,8,13,16H2,1-2H3,(H,28,29)