N,N'-bis[3-oxidanyl-1,4-diphenyl-3-(phenylmethyl)butan-2-yl]propanediamide

Systemtic Name: N,N'-bis[3-oxidanyl-1,4-diphenyl-3-(phenylmethyl)butan-2-yl]propanediamide Openeye Name: N,N'-bis(1,2-dibenzyl-2-hydroxy-3-phenyl-propyl)propanediamide CAS Name: N,N'-bis[3-hydroxy-1,4-diphenyl-3-(phenylmethyl)butan-2-yl]propanediamide IUPAC Name: N,N'-bis(3-benzyl-3-hydroxy-1,4-diphenylbutan-2-yl)propanediamide Traditional Name: N,N'-bis(1,2-dibenzyl-2-hydroxy-3-phenyl-propyl)malonamide Formula: C49H50N2O4 MolecularWeight: 730.9323

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(CC2=CC=CC=C2)(CC3=CC=CC=C3)O)NC(=O)CC(=O)NC(CC4=CC=CC=C4)C(CC5=CC=CC=C5)(CC6=CC=CC=C6)O

Isomeric SMILES

C1=CC=C(C=C1)CC(C(CC2=CC=CC=C2)(CC3=CC=CC=C3)O)NC(=O)CC(=O)NC(CC4=CC=CC=C4)C(CC5=CC=CC=C5)(CC6=CC=CC=C6)O

InChI

InChI=1S/C49H50N2O4/c52-46(50-44(31-38-19-7-1-8-20-38)48(54,34-40-23-11-3-12-24-40)35-41-25-13-4-14-26-41)33-47(53)51-45(32-39-21-9-2-10-22-39)49(55,36-42-27-15-5-16-28-42)37-43-29-17-6-18-30-43/h1-30,44-45,54-55H,31-37H2,(H,50,52)(H,51,53)