1-[6-(2-carboxypyrrolidin-1-yl)-6-oxidanylidene-2,5-bis(phenylmethyl)hexanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[6-(2-carboxypyrrolidin-1-yl)-6-oxidanylidene-2,5-bis(phenylmethyl)hexanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[2,5-dibenzyl-6-(2-carboxypyrrolidin-1-yl)-6-oxo-hexanoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[6-(2-carboxy-1-pyrrolidinyl)-1,6-dioxo-2,5-bis(phenylmethyl)hexyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[2,5-dibenzyl-6-(2-carboxypyrrolidin-1-yl)-6-oxohexanoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[2,5-dibenzyl-6-(2-carboxypyrrolidino)-6-keto-hexanoyl]proline Formula: C30H36N2O6 MolecularWeight: 520.61664

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C(CCC(CC2=CC=CC=C2)C(=O)N3CCCC3C(=O)O)CC4=CC=CC=C4)C(=O)O

Isomeric SMILES

C1CC(N(C1)C(=O)C(CCC(CC2=CC=CC=C2)C(=O)N3CCCC3C(=O)O)CC4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C30H36N2O6/c33-27(31-17-7-13-25(31)29(35)36)23(19-21-9-3-1-4-10-21)15-16-24(20-22-11-5-2-6-12-22)28(34)32-18-8-14-26(32)30(37)38/h1-6,9-12,23-26H,7-8,13-20H2,(H,35,36)(H,37,38)