(phenylmethyl) (2S)-2-[[(2S,3R)-3-azido-2-oxidanyl-4-phenyl-butanoyl]amino]-4-methyl-pentanoate

Systemtic Name: (phenylmethyl) (2S)-2-[[(2S,3R)-3-azido-2-oxidanyl-4-phenyl-butanoyl]amino]-4-methyl-pentanoate Openeye Name: benzyl (2S)-2-[[(2S,3R)-3-azido-2-hydroxy-4-phenyl-butanoyl]amino]-4-methyl-pentanoate CAS Name: (2S)-2-[[(2S,3R)-3-azido-2-hydroxy-1-oxo-4-phenylbutyl]amino]-4-methylpentanoic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-2-[[(2S,3R)-3-azido-2-hydroxy-4-phenylbutanoyl]amino]-4-methylpentanoate Traditional Name: (2S)-2-[[(2S,3R)-3-azido-2-hydroxy-4-phenyl-butanoyl]amino]-4-methyl-valeric acid benzyl ester Formula: C23H28N4O4 MolecularWeight: 424.49282

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OCC1=CC=CC=C1)NC(=O)C(C(CC2=CC=CC=C2)N=[N+]=[N-])O

Isomeric SMILES

CC(C)C[C@@H](C(=O)OCC1=CC=CC=C1)NC(=O)[C@H]([C@@H](CC2=CC=CC=C2)N=[N+]=[N-])O

InChI

InChI=1S/C23H28N4O4/c1-16(2)13-20(23(30)31-15-18-11-7-4-8-12-18)25-22(29)21(28)19(26-27-24)14-17-9-5-3-6-10-17/h3-12,16,19-21,28H,13-15H2,1-2H3,(H,25,29)/t19-,20+,21+/m1/s1