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

Systemtic Name: ethyl (2R,3S)-4-cyclohexyl-3-[[(2S)-4-methyl-2-(2-phenylethanoylamino)pentanoyl]amino]-2-oxidanyl-butanoate Openeye Name: ethyl (2R,3S)-4-cyclohexyl-2-hydroxy-3-[[(2S)-4-methyl-2-[(2-phenylacetyl)amino]pentanoyl]amino]butanoate CAS Name: (2R,3S)-4-cyclohexyl-2-hydroxy-3-[[(2S)-4-methyl-1-oxo-2-[(1-oxo-2-phenylethyl)amino]pentyl]amino]butanoic acid ethyl ester IUPAC Name: ethyl (2R,3S)-4-cyclohexyl-2-hydroxy-3-[[(2S)-4-methyl-2-[(2-phenylacetyl)amino]pentanoyl]amino]butanoate Traditional Name: (2R,3S)-4-cyclohexyl-2-hydroxy-3-[[(2S)-4-methyl-2-[(2-phenylacetyl)amino]pentanoyl]amino]butyric acid ethyl ester Formula: C26H40N2O5 MolecularWeight: 460.6062

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H40N2O5/c1-4-33-26(32)24(30)21(16-19-11-7-5-8-12-19)28-25(31)22(15-18(2)3)27-23(29)17-20-13-9-6-10-14-20/h6,9-10,13-14,18-19,21-22,24,30H,4-5,7-8,11-12,15-17H2,1-3H3,(H,27,29)(H,28,31)/t21-,22-,24+/m0/s1