(phenylmethyl) N-[3-oxidanyl-4-[[(2S)-1-oxidanylidenepentan-2-yl]carbamoyl-phenethyl-amino]-1-phenyl-butan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[3-oxidanyl-4-[[(2S)-1-oxidanylidenepentan-2-yl]carbamoyl-phenethyl-amino]-1-phenyl-butan-2-yl]carbamate Openeye Name: benzyl N-[1-benzyl-3-[[(1S)-1-formylbutyl]carbamoyl-phenethyl-amino]-2-hydroxy-propyl]carbamate CAS Name: N-[3-hydroxy-4-[[oxo-[[(2S)-1-oxopentan-2-yl]amino]methyl]-phenethylamino]-1-phenylbutan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[3-hydroxy-4-[[(2S)-1-oxopentan-2-yl]carbamoyl-phenethylamino]-1-phenylbutan-2-yl]carbamate Traditional Name: N-[1-benzyl-3-[[(1S)-1-formylbutyl]carbamoyl-phenethyl-amino]-2-hydroxy-propyl]carbamic acid benzyl ester Formula: C32H39N3O5 MolecularWeight: 545.66916

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C=O)NC(=O)N(CCC1=CC=CC=C1)CC(C(CC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3)O

Isomeric SMILES

CCC[C@@H](C=O)NC(=O)N(CCC1=CC=CC=C1)CC(C(CC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3)O

InChI

InChI=1S/C32H39N3O5/c1-2-12-28(23-36)33-31(38)35(20-19-25-13-6-3-7-14-25)22-30(37)29(21-26-15-8-4-9-16-26)34-32(39)40-24-27-17-10-5-11-18-27/h3-11,13-18,23,28-30,37H,2,12,19-22,24H2,1H3,(H,33,38)(H,34,39)/t28-,29?,30?/m0/s1