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

Systemtic Name: 1-[(4-ethoxy-3-methoxy-phenyl)-naphthalen-2-yl-methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(4-ethoxy-3-methoxy-phenyl)-(2-naphthyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(4-ethoxy-3-methoxyphenyl)-(2-naphthalenyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(4-ethoxy-3-methoxyphenyl)-naphthalen-2-ylmethyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(4-ethoxy-3-methoxy-phenyl)-(2-naphthyl)methyl]proline Formula: C25H27NO4 MolecularWeight: 405.48618

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H27NO4/c1-3-30-22-13-12-20(16-23(22)29-2)24(26-14-6-9-21(26)25(27)28)19-11-10-17-7-4-5-8-18(17)15-19/h4-5,7-8,10-13,15-16,21,24H,3,6,9,14H2,1-2H3,(H,27,28)