1-[(3-ethoxy-4-phenylmethoxy-phenyl)-naphthalen-2-yl-methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(3-ethoxy-4-phenylmethoxy-phenyl)-naphthalen-2-yl-methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(4-benzyloxy-3-ethoxy-phenyl)-(2-naphthyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(3-ethoxy-4-phenylmethoxyphenyl)-(2-naphthalenyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(3-ethoxy-4-phenylmethoxyphenyl)-naphthalen-2-ylmethyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(4-benzoxy-3-ethoxy-phenyl)-(2-naphthyl)methyl]proline Formula: C31H31NO4 MolecularWeight: 481.58214

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(C2=CC3=CC=CC=C3C=C2)N4CCCC4C(=O)O)OCC5=CC=CC=C5

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(C2=CC3=CC=CC=C3C=C2)N4CCCC4C(=O)O)OCC5=CC=CC=C5

InChI

InChI=1S/C31H31NO4/c1-2-35-29-20-26(16-17-28(29)36-21-22-9-4-3-5-10-22)30(32-18-8-13-27(32)31(33)34)25-15-14-23-11-6-7-12-24(23)19-25/h3-7,9-12,14-17,19-20,27,30H,2,8,13,18,21H2,1H3,(H,33,34)