2-(2-methylpropyl)-1-[4-(2-octan-4-yloxyphenyl)carbonyloxyphenyl]carbonyl-pyrrolidine-2-carboxylic acid

Systemtic Name: 2-(2-methylpropyl)-1-[4-(2-octan-4-yloxyphenyl)carbonyloxyphenyl]carbonyl-pyrrolidine-2-carboxylic acid Openeye Name: 2-isobutyl-1-[4-[2-(1-propylpentoxy)benzoyl]oxybenzoyl]pyrrolidine-2-carboxylic acid CAS Name: 2-(2-methylpropyl)-1-[[4-[(2-octan-4-yloxyphenyl)-oxomethoxy]phenyl]-oxomethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 2-(2-methylpropyl)-1-[4-(2-octan-4-yloxybenzoyl)oxybenzoyl]pyrrolidine-2-carboxylic acid Traditional Name: 2-isobutyl-1-[4-[2-(1-propylpentoxy)benzoyl]oxybenzoyl]proline Formula: C31H41NO6 MolecularWeight: 523.66034

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CCC)OC1=CC=CC=C1C(=O)OC2=CC=C(C=C2)C(=O)N3CCCC3(CC(C)C)C(=O)O

Isomeric SMILES

CCCCC(CCC)OC1=CC=CC=C1C(=O)OC2=CC=C(C=C2)C(=O)N3CCCC3(CC(C)C)C(=O)O

InChI

InChI=1S/C31H41NO6/c1-5-7-12-24(11-6-2)37-27-14-9-8-13-26(27)29(34)38-25-17-15-23(16-18-25)28(33)32-20-10-19-31(32,30(35)36)21-22(3)4/h8-9,13-18,22,24H,5-7,10-12,19-21H2,1-4H3,(H,35,36)