1-[3-[(2-methyl-3-oxidanyl-phenyl)carbonylamino]-2-oxidanyl-4-phenyl-butanoyl]-N-(3-morpholin-4-ylpropyl)-4-oxidanyl-pyrrolidine-2-carboxamide

Systemtic Name: 1-[3-[(2-methyl-3-oxidanyl-phenyl)carbonylamino]-2-oxidanyl-4-phenyl-butanoyl]-N-(3-morpholin-4-ylpropyl)-4-oxidanyl-pyrrolidine-2-carboxamide Openeye Name: 4-hydroxy-1-[2-hydroxy-3-[(3-hydroxy-2-methyl-benzoyl)amino]-4-phenyl-butanoyl]-N-(3-morpholinopropyl)pyrrolidine-2-carboxamide CAS Name: 4-hydroxy-1-[2-hydroxy-3-[[(3-hydroxy-2-methylphenyl)-oxomethyl]amino]-1-oxo-4-phenylbutyl]-N-[3-(4-morpholinyl)propyl]-2-pyrrolidinecarboxamide IUPAC Name: 4-hydroxy-1-[2-hydroxy-3-[(3-hydroxy-2-methylbenzoyl)amino]-4-phenylbutanoyl]-N-(3-morpholin-4-ylpropyl)pyrrolidine-2-carboxamide Traditional Name: 4-hydroxy-1-[2-hydroxy-3-[(3-hydroxy-2-methyl-benzoyl)amino]-4-phenyl-butanoyl]-N-(3-morpholinopropyl)pyrrolidine-2-carboxamide Formula: C30H40N4O7 MolecularWeight: 568.6612

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1O)C(=O)NC(CC2=CC=CC=C2)C(C(=O)N3CC(CC3C(=O)NCCCN4CCOCC4)O)O

Isomeric SMILES

CC1=C(C=CC=C1O)C(=O)NC(CC2=CC=CC=C2)C(C(=O)N3CC(CC3C(=O)NCCCN4CCOCC4)O)O

InChI

InChI=1S/C30H40N4O7/c1-20-23(9-5-10-26(20)36)28(38)32-24(17-21-7-3-2-4-8-21)27(37)30(40)34-19-22(35)18-25(34)29(39)31-11-6-12-33-13-15-41-16-14-33/h2-5,7-10,22,24-25,27,35-37H,6,11-19H2,1H3,(H,31,39)(H,32,38)