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

Systemtic Name: 1-[4-(4-octoxyphenyl)carbonyloxyphenyl]carbonylpyrrolidine-2-carboxylic acid Openeye Name: 1-[4-(4-octoxybenzoyl)oxybenzoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[[4-[(4-octoxyphenyl)-oxomethoxy]phenyl]-oxomethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[4-(4-octoxybenzoyl)oxybenzoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[4-(4-octoxybenzoyl)oxybenzoyl]proline Formula: C27H33NO6 MolecularWeight: 467.55402

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)N3CCCC3C(=O)O

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)N3CCCC3C(=O)O

InChI

InChI=1S/C27H33NO6/c1-2-3-4-5-6-7-19-33-22-14-12-21(13-15-22)27(32)34-23-16-10-20(11-17-23)25(29)28-18-8-9-24(28)26(30)31/h10-17,24H,2-9,18-19H2,1H3,(H,30,31)