ethyl (2R,3S)-4-cyclohexyl-3-[[(2R)-3-methyl-2-(2-phenylethanoylamino)butanoyl]amino]-2-oxidanyl-butanoate

Systemtic Name: ethyl (2R,3S)-4-cyclohexyl-3-[[(2R)-3-methyl-2-(2-phenylethanoylamino)butanoyl]amino]-2-oxidanyl-butanoate Openeye Name: ethyl (2R,3S)-4-cyclohexyl-2-hydroxy-3-[[(2R)-3-methyl-2-[(2-phenylacetyl)amino]butanoyl]amino]butanoate CAS Name: (2R,3S)-4-cyclohexyl-2-hydroxy-3-[[(2R)-3-methyl-1-oxo-2-[(1-oxo-2-phenylethyl)amino]butyl]amino]butanoic acid ethyl ester IUPAC Name: ethyl (2R,3S)-4-cyclohexyl-2-hydroxy-3-[[(2R)-3-methyl-2-[(2-phenylacetyl)amino]butanoyl]amino]butanoate Traditional Name: (2R,3S)-4-cyclohexyl-2-hydroxy-3-[[(2R)-3-methyl-2-[(2-phenylacetyl)amino]butanoyl]amino]butyric acid ethyl ester Formula: C25H38N2O5 MolecularWeight: 446.57962

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(CC1CCCCC1)NC(=O)C(C(C)C)NC(=O)CC2=CC=CC=C2)O

Isomeric SMILES

CCOC(=O)[C@@H]([C@H](CC1CCCCC1)NC(=O)[C@@H](C(C)C)NC(=O)CC2=CC=CC=C2)O

InChI

InChI=1S/C25H38N2O5/c1-4-32-25(31)23(29)20(15-18-11-7-5-8-12-18)26-24(30)22(17(2)3)27-21(28)16-19-13-9-6-10-14-19/h6,9-10,13-14,17-18,20,22-23,29H,4-5,7-8,11-12,15-16H2,1-3H3,(H,26,30)(H,27,28)/t20-,22+,23+/m0/s1