phenyl (2S,3R)-3-cyclohexyl-2-methyl-3-phenylazanyl-propanoate

Systemtic Name: phenyl (2S,3R)-3-cyclohexyl-2-methyl-3-phenylazanyl-propanoate Openeye Name: phenyl (2S,3R)-3-anilino-3-cyclohexyl-2-methyl-propanoate CAS Name: (2S,3R)-3-anilino-3-cyclohexyl-2-methylpropanoic acid phenyl ester IUPAC Name: phenyl (2S,3R)-3-anilino-3-cyclohexyl-2-methylpropanoate Traditional Name: (2S,3R)-3-anilino-3-cyclohexyl-2-methyl-propionic acid phenyl ester Formula: C22H27NO2 MolecularWeight: 337.45528

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1CCCCC1)NC2=CC=CC=C2)C(=O)OC3=CC=CC=C3

Isomeric SMILES

C[C@@H]([C@@H](C1CCCCC1)NC2=CC=CC=C2)C(=O)OC3=CC=CC=C3

InChI

InChI=1S/C22H27NO2/c1-17(22(24)25-20-15-9-4-10-16-20)21(18-11-5-2-6-12-18)23-19-13-7-3-8-14-19/h3-4,7-10,13-18,21,23H,2,5-6,11-12H2,1H3/t17-,21-/m0/s1