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

Systemtic Name: 4-azanyl-N-[(4-methoxyphenyl)methyl]-1-[3-[(2-methyl-3-oxidanyl-phenyl)carbonylamino]-2-oxidanyl-4-phenyl-butanoyl]pyrrolidine-2-carboxamide Openeye Name: 4-amino-1-[2-hydroxy-3-[(3-hydroxy-2-methyl-benzoyl)amino]-4-phenyl-butanoyl]-N-[(4-methoxyphenyl)methyl]pyrrolidine-2-carboxamide CAS Name: 4-amino-1-[2-hydroxy-3-[[(3-hydroxy-2-methylphenyl)-oxomethyl]amino]-1-oxo-4-phenylbutyl]-N-[(4-methoxyphenyl)methyl]-2-pyrrolidinecarboxamide IUPAC Name: 4-amino-1-[2-hydroxy-3-[(3-hydroxy-2-methylbenzoyl)amino]-4-phenylbutanoyl]-N-[(4-methoxyphenyl)methyl]pyrrolidine-2-carboxamide Traditional Name: 4-amino-1-[2-hydroxy-3-[(3-hydroxy-2-methyl-benzoyl)amino]-4-phenyl-butanoyl]-N-p-anisyl-pyrrolidine-2-carboxamide Formula: C31H36N4O6 MolecularWeight: 560.64074

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)NCC4=CC=C(C=C4)OC)N)O

Isomeric SMILES

CC1=C(C=CC=C1O)C(=O)NC(CC2=CC=CC=C2)C(C(=O)N3CC(CC3C(=O)NCC4=CC=C(C=C4)OC)N)O

InChI

InChI=1S/C31H36N4O6/c1-19-24(9-6-10-27(19)36)29(38)34-25(15-20-7-4-3-5-8-20)28(37)31(40)35-18-22(32)16-26(35)30(39)33-17-21-11-13-23(41-2)14-12-21/h3-14,22,25-26,28,36-37H,15-18,32H2,1-2H3,(H,33,39)(H,34,38)