N-[(2S)-1-oxidanylidene-1-(phenethylamino)-3-phenyl-propan-2-yl]-N'-phenylmethoxy-octanediamide

Systemtic Name: N-[(2S)-1-oxidanylidene-1-(phenethylamino)-3-phenyl-propan-2-yl]-N'-phenylmethoxy-octanediamide Openeye Name: N-[(1S)-1-benzyl-2-oxo-2-(phenethylamino)ethyl]-N'-benzyloxy-octanediamide CAS Name: N-[(2S)-1-oxo-1-(phenethylamino)-3-phenylpropan-2-yl]-N'-phenylmethoxyoctanediamide IUPAC Name: N-[(2S)-1-oxo-1-(phenethylamino)-3-phenylpropan-2-yl]-N'-phenylmethoxyoctanediamide Traditional Name: N'-benzoxy-N-[(1S)-1-benzyl-2-keto-2-(phenethylamino)ethyl]suberamide Formula: C32H39N3O4 MolecularWeight: 529.66976

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=O)C(CC2=CC=CC=C2)NC(=O)CCCCCCC(=O)NOCC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)CCCCCCC(=O)NOCC3=CC=CC=C3

InChI

InChI=1S/C32H39N3O4/c36-30(20-12-1-2-13-21-31(37)35-39-25-28-18-10-5-11-19-28)34-29(24-27-16-8-4-9-17-27)32(38)33-23-22-26-14-6-3-7-15-26/h3-11,14-19,29H,1-2,12-13,20-25H2,(H,33,38)(H,34,36)(H,35,37)/t29-/m0/s1