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

Systemtic Name: (phenylmethyl) N-[3-oxidanyl-4-[[(2S)-1-oxidanylidenehexan-2-yl]carbamoyl-phenethyl-amino]-1-phenyl-butan-2-yl]carbamate Openeye Name: benzyl N-[1-benzyl-3-[[(1S)-1-formylpentyl]carbamoyl-phenethyl-amino]-2-hydroxy-propyl]carbamate CAS Name: N-[3-hydroxy-4-[[oxo-[[(2S)-1-oxohexan-2-yl]amino]methyl]-phenethylamino]-1-phenylbutan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[3-hydroxy-4-[[(2S)-1-oxohexan-2-yl]carbamoyl-phenethylamino]-1-phenylbutan-2-yl]carbamate Traditional Name: N-[1-benzyl-3-[[(1S)-1-formylpentyl]carbamoyl-phenethyl-amino]-2-hydroxy-propyl]carbamic acid benzyl ester Formula: C33H41N3O5 MolecularWeight: 559.69574

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCC[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/C33H41N3O5/c1-2-3-19-29(24-37)34-32(39)36(21-20-26-13-7-4-8-14-26)23-31(38)30(22-27-15-9-5-10-16-27)35-33(40)41-25-28-17-11-6-12-18-28/h4-18,24,29-31,38H,2-3,19-23,25H2,1H3,(H,34,39)(H,35,40)/t29-,30?,31?/m0/s1