N-[(2S,3R)-4-[(3-methoxyphenyl)methylamino]-3-oxidanyl-1-phenyl-butan-2-yl]-3-(2-oxidanylidenepyrrolidin-1-yl)-5-phenethyl-benzamide

Systemtic Name: N-[(2S,3R)-4-[(3-methoxyphenyl)methylamino]-3-oxidanyl-1-phenyl-butan-2-yl]-3-(2-oxidanylidenepyrrolidin-1-yl)-5-phenethyl-benzamide Openeye Name: N-[(1S,2R)-1-benzyl-2-hydroxy-3-[(3-methoxyphenyl)methylamino]propyl]-3-(2-oxopyrrolidin-1-yl)-5-phenethyl-benzamide CAS Name: N-[(2S,3R)-3-hydroxy-4-[(3-methoxyphenyl)methylamino]-1-phenylbutan-2-yl]-3-(2-oxo-1-pyrrolidinyl)-5-phenethylbenzamide IUPAC Name: N-[(2S,3R)-3-hydroxy-4-[(3-methoxyphenyl)methylamino]-1-phenylbutan-2-yl]-3-(2-oxopyrrolidin-1-yl)-5-phenethylbenzamide Traditional Name: N-[(1S,2R)-1-benzyl-2-hydroxy-3-(m-anisylamino)propyl]-3-(2-ketopyrrolidino)-5-phenethyl-benzamide Formula: C37H41N3O4 MolecularWeight: 591.73914

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CNCC(C(CC2=CC=CC=C2)NC(=O)C3=CC(=CC(=C3)N4CCCC4=O)CCC5=CC=CC=C5)O

Isomeric SMILES

COC1=CC=CC(=C1)CNC[C@H]([C@H](CC2=CC=CC=C2)NC(=O)C3=CC(=CC(=C3)N4CCCC4=O)CCC5=CC=CC=C5)O

InChI

InChI=1S/C37H41N3O4/c1-44-33-15-8-14-30(22-33)25-38-26-35(41)34(23-28-12-6-3-7-13-28)39-37(43)31-20-29(18-17-27-10-4-2-5-11-27)21-32(24-31)40-19-9-16-36(40)42/h2-8,10-15,20-22,24,34-35,38,41H,9,16-19,23,25-26H2,1H3,(H,39,43)/t34-,35+/m0/s1