methyl (2S)-2-[[(3R)-3-azanyl-3-cyclohexyl-2,2-bis(fluoranyl)propanoyl]amino]-3-phenyl-propanoate

Systemtic Name: methyl (2S)-2-[[(3R)-3-azanyl-3-cyclohexyl-2,2-bis(fluoranyl)propanoyl]amino]-3-phenyl-propanoate Openeye Name: methyl (2S)-2-[[(3R)-3-amino-3-cyclohexyl-2,2-difluoro-propanoyl]amino]-3-phenyl-propanoate CAS Name: (2S)-2-[[(3R)-3-amino-3-cyclohexyl-2,2-difluoro-1-oxopropyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[(3R)-3-amino-3-cyclohexyl-2,2-difluoropropanoyl]amino]-3-phenylpropanoate Traditional Name: (2S)-2-[[(3R)-3-amino-3-cyclohexyl-2,2-difluoro-propanoyl]amino]-3-phenyl-propionic acid methyl ester Formula: C19H26F2N2O3 MolecularWeight: 368.418146

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1)NC(=O)C(C(C2CCCCC2)N)(F)F

Isomeric SMILES

COC(=O)[C@H](CC1=CC=CC=C1)NC(=O)C([C@@H](C2CCCCC2)N)(F)F

InChI

InChI=1S/C19H26F2N2O3/c1-26-17(24)15(12-13-8-4-2-5-9-13)23-18(25)19(20,21)16(22)14-10-6-3-7-11-14/h2,4-5,8-9,14-16H,3,6-7,10-12,22H2,1H3,(H,23,25)/t15-,16+/m0/s1