1-[4-(2-azanylethanoylamino)pyrrolidin-2-yl]carbonyl-4-[(2-oxidanyl-4-phenyl-butanoyl)amino]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[4-(2-azanylethanoylamino)pyrrolidin-2-yl]carbonyl-4-[(2-oxidanyl-4-phenyl-butanoyl)amino]pyrrolidine-2-carboxylic acid Openeye Name: 1-[4-[(2-aminoacetyl)amino]pyrrolidine-2-carbonyl]-4-[(2-hydroxy-4-phenyl-butanoyl)amino]pyrrolidine-2-carboxylic acid CAS Name: 1-[[4-[(2-amino-1-oxoethyl)amino]-2-pyrrolidinyl]-oxomethyl]-4-[(2-hydroxy-1-oxo-4-phenylbutyl)amino]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[4-[(2-aminoacetyl)amino]pyrrolidine-2-carbonyl]-4-[(2-hydroxy-4-phenylbutanoyl)amino]pyrrolidine-2-carboxylic acid Traditional Name: 1-[4-(glycylamino)prolyl]-4-[(2-hydroxy-4-phenyl-butanoyl)amino]proline Formula: C22H31N5O6 MolecularWeight: 461.51144

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CNC1C(=O)N2CC(CC2C(=O)O)NC(=O)C(CCC3=CC=CC=C3)O)NC(=O)CN

Isomeric SMILES

C1C(CNC1C(=O)N2CC(CC2C(=O)O)NC(=O)C(CCC3=CC=CC=C3)O)NC(=O)CN

InChI

InChI=1S/C22H31N5O6/c23-10-19(29)25-14-8-16(24-11-14)21(31)27-12-15(9-17(27)22(32)33)26-20(30)18(28)7-6-13-4-2-1-3-5-13/h1-5,14-18,24,28H,6-12,23H2,(H,25,29)(H,26,30)(H,32,33)