4-(2-azanylethanoylamino)-4-[(2-oxidanyl-4-phenyl-butanoyl)amino]-1-piperidin-2-ylcarbonyl-pyrrolidine-2-carboxylic acid

Systemtic Name: 4-(2-azanylethanoylamino)-4-[(2-oxidanyl-4-phenyl-butanoyl)amino]-1-piperidin-2-ylcarbonyl-pyrrolidine-2-carboxylic acid Openeye Name: 4-[(2-aminoacetyl)amino]-4-[(2-hydroxy-4-phenyl-butanoyl)amino]-1-(piperidine-2-carbonyl)pyrrolidine-2-carboxylic acid CAS Name: 4-[(2-amino-1-oxoethyl)amino]-4-[(2-hydroxy-1-oxo-4-phenylbutyl)amino]-1-[oxo(2-piperidinyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 4-[(2-aminoacetyl)amino]-4-[(2-hydroxy-4-phenylbutanoyl)amino]-1-(piperidine-2-carbonyl)pyrrolidine-2-carboxylic acid Traditional Name: 4-(glycylamino)-4-[(2-hydroxy-4-phenyl-butanoyl)amino]-1-pipecoloyl-proline Formula: C23H33N5O6 MolecularWeight: 475.53802

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(C1)C(=O)N2CC(CC2C(=O)O)(NC(=O)CN)NC(=O)C(CCC3=CC=CC=C3)O

Isomeric SMILES

C1CCNC(C1)C(=O)N2CC(CC2C(=O)O)(NC(=O)CN)NC(=O)C(CCC3=CC=CC=C3)O

InChI

InChI=1S/C23H33N5O6/c24-13-19(30)26-23(27-20(31)18(29)10-9-15-6-2-1-3-7-15)12-17(22(33)34)28(14-23)21(32)16-8-4-5-11-25-16/h1-3,6-7,16-18,25,29H,4-5,8-14,24H2,(H,26,30)(H,27,31)(H,33,34)