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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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