1-[(2S)-5-oxidanyl-5-oxidanylidene-4-(phenoxymethyl)-2-[(4-phenylphenyl)methyl]pentanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(2S)-5-oxidanyl-5-oxidanylidene-4-(phenoxymethyl)-2-[(4-phenylphenyl)methyl]pentanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(2S)-5-hydroxy-5-oxo-4-(phenoxymethyl)-2-[(4-phenylphenyl)methyl]pentanoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(2S)-5-hydroxy-1,5-dioxo-4-(phenoxymethyl)-2-[(4-phenylphenyl)methyl]pentyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(2S)-5-hydroxy-5-oxo-4-(phenoxymethyl)-2-[(4-phenylphenyl)methyl]pentanoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(2S)-5-hydroxy-5-keto-4-(phenoxymethyl)-2-(4-phenylbenzyl)pentanoyl]proline Formula: C30H31NO6 MolecularWeight: 501.57024

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C(CC2=CC=C(C=C2)C3=CC=CC=C3)CC(COC4=CC=CC=C4)C(=O)O)C(=O)O

Isomeric SMILES

C1CC(N(C1)C(=O)[C@H](CC2=CC=C(C=C2)C3=CC=CC=C3)CC(COC4=CC=CC=C4)C(=O)O)C(=O)O

InChI

InChI=1S/C30H31NO6/c32-28(31-17-7-12-27(31)30(35)36)24(19-25(29(33)34)20-37-26-10-5-2-6-11-26)18-21-13-15-23(16-14-21)22-8-3-1-4-9-22/h1-6,8-11,13-16,24-25,27H,7,12,17-20H2,(H,33,34)(H,35,36)/t24-,25?,27?/m1/s1