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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(C2=CC3=CC=CC=C3C=C2)N4CCCC4C(=O)O)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(C2=CC3=CC=CC=C3C=C2)N4CCCC4C(=O)O)OCC

InChI

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