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

Systemtic Name: 1-[4-(4-octylphenyl)phenyl]carbonylpyrrolidine-2-carboxylic acid Openeye Name: 1-[4-(4-octylphenyl)benzoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[[4-(4-octylphenyl)phenyl]-oxomethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[4-(4-octylphenyl)benzoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[4-(4-octylphenyl)benzoyl]proline Formula: C26H33NO3 MolecularWeight: 407.54512

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)N3CCCC3C(=O)O

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)N3CCCC3C(=O)O

InChI

InChI=1S/C26H33NO3/c1-2-3-4-5-6-7-9-20-11-13-21(14-12-20)22-15-17-23(18-16-22)25(28)27-19-8-10-24(27)26(29)30/h11-18,24H,2-10,19H2,1H3,(H,29,30)