1-[4-(4-octoxyphenyl)phenyl]carbonylpyrrolidine-2-carboxylic acid

Systemtic Name: 1-[4-(4-octoxyphenyl)phenyl]carbonylpyrrolidine-2-carboxylic acid Openeye Name: 1-[4-(4-octoxyphenyl)benzoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[[4-(4-octoxyphenyl)phenyl]-oxomethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[4-(4-octoxyphenyl)benzoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[4-(4-octoxyphenyl)benzoyl]proline Formula: C26H33NO4 MolecularWeight: 423.54452

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)N3CCCC3C(=O)O

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)N3CCCC3C(=O)O

InChI

InChI=1S/C26H33NO4/c1-2-3-4-5-6-7-19-31-23-16-14-21(15-17-23)20-10-12-22(13-11-20)25(28)27-18-8-9-24(27)26(29)30/h10-17,24H,2-9,18-19H2,1H3,(H,29,30)