2,3-bis(oxidanyl)-N,N'-bis[1-oxidanylidene-1-(phenethylamino)-4-phenyl-butan-2-yl]butanediamide

Systemtic Name: 2,3-bis(oxidanyl)-N,N'-bis[1-oxidanylidene-1-(phenethylamino)-4-phenyl-butan-2-yl]butanediamide Openeye Name: 2,3-dihydroxy-N,N'-bis[1-(phenethylcarbamoyl)-3-phenyl-propyl]butanediamide CAS Name: 2,3-dihydroxy-N,N'-bis[1-oxo-1-(phenethylamino)-4-phenylbutan-2-yl]butanediamide IUPAC Name: 2,3-dihydroxy-N,N'-bis[1-oxo-1-(phenethylamino)-4-phenylbutan-2-yl]butanediamide Traditional Name: 2,3-dihydroxy-N,N'-bis[1-(phenethylcarbamoyl)-3-phenyl-propyl]succinamide Formula: C40H46N4O6 MolecularWeight: 678.81644

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(C(=O)NCCC2=CC=CC=C2)NC(=O)C(C(C(=O)NC(CCC3=CC=CC=C3)C(=O)NCCC4=CC=CC=C4)O)O

Isomeric SMILES

C1=CC=C(C=C1)CCC(C(=O)NCCC2=CC=CC=C2)NC(=O)C(C(C(=O)NC(CCC3=CC=CC=C3)C(=O)NCCC4=CC=CC=C4)O)O

InChI

InChI=1S/C40H46N4O6/c45-35(39(49)43-33(23-21-29-13-5-1-6-14-29)37(47)41-27-25-31-17-9-3-10-18-31)36(46)40(50)44-34(24-22-30-15-7-2-8-16-30)38(48)42-28-26-32-19-11-4-12-20-32/h1-20,33-36,45-46H,21-28H2,(H,41,47)(H,42,48)(H,43,49)(H,44,50)