1-[2-[(4-oxidanyl-4-oxidanylidene-2-phenethyl-butanoyl)amino]propanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[2-[(4-oxidanyl-4-oxidanylidene-2-phenethyl-butanoyl)amino]propanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[2-[(4-hydroxy-4-oxo-2-phenethyl-butanoyl)amino]propanoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[2-[(4-hydroxy-1,4-dioxo-2-phenethylbutyl)amino]-1-oxopropyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[2-[(4-hydroxy-4-oxo-2-phenethylbutanoyl)amino]propanoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[2-[(4-hydroxy-4-keto-2-phenethyl-butanoyl)amino]propanoyl]proline Formula: C20H26N2O6 MolecularWeight: 390.43024

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCC1C(=O)O)NC(=O)C(CCC2=CC=CC=C2)CC(=O)O

Isomeric SMILES

CC(C(=O)N1CCCC1C(=O)O)NC(=O)C(CCC2=CC=CC=C2)CC(=O)O

InChI

InChI=1S/C20H26N2O6/c1-13(19(26)22-11-5-8-16(22)20(27)28)21-18(25)15(12-17(23)24)10-9-14-6-3-2-4-7-14/h2-4,6-7,13,15-16H,5,8-12H2,1H3,(H,21,25)(H,23,24)(H,27,28)