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

Systemtic Name: cyclohexylmethyl (2S)-2-[[(2R,3R)-3-azanyl-2-oxidanyl-4-phenyl-butanoyl]amino]-4-methyl-pentanoate Openeye Name: cyclohexylmethyl (2S)-2-[[(2R,3R)-3-amino-2-hydroxy-4-phenyl-butanoyl]amino]-4-methyl-pentanoate CAS Name: (2S)-2-[[(2R,3R)-3-amino-2-hydroxy-1-oxo-4-phenylbutyl]amino]-4-methylpentanoic acid cyclohexylmethyl ester IUPAC Name: cyclohexylmethyl (2S)-2-[[(2R,3R)-3-amino-2-hydroxy-4-phenylbutanoyl]amino]-4-methylpentanoate Traditional Name: (2S)-2-[[(2R,3R)-3-amino-2-hydroxy-4-phenyl-butanoyl]amino]-4-methyl-valeric acid cyclohexylmethyl ester Formula: C23H36N2O4 MolecularWeight: 404.54294

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OCC1CCCCC1)NC(=O)C(C(CC2=CC=CC=C2)N)O

Isomeric SMILES

CC(C)C[C@@H](C(=O)OCC1CCCCC1)NC(=O)[C@@H]([C@@H](CC2=CC=CC=C2)N)O

InChI

InChI=1S/C23H36N2O4/c1-16(2)13-20(23(28)29-15-18-11-7-4-8-12-18)25-22(27)21(26)19(24)14-17-9-5-3-6-10-17/h3,5-6,9-10,16,18-21,26H,4,7-8,11-15,24H2,1-2H3,(H,25,27)/t19-,20+,21-/m1/s1