tert-butyl (2S,3S)-3-azanyl-3-cyclohexyl-2-(phenylmethyl)propanoate

Systemtic Name: tert-butyl (2S,3S)-3-azanyl-3-cyclohexyl-2-(phenylmethyl)propanoate Openeye Name: tert-butyl (2S,3S)-3-amino-2-benzyl-3-cyclohexyl-propanoate CAS Name: (2S,3S)-3-amino-3-cyclohexyl-2-(phenylmethyl)propanoic acid tert-butyl ester IUPAC Name: tert-butyl (2S,3S)-3-amino-2-benzyl-3-cyclohexylpropanoate Traditional Name: (2S,3S)-3-amino-2-benzyl-3-cyclohexyl-propionic acid tert-butyl ester Formula: C20H31NO2 MolecularWeight: 317.46564

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(CC1=CC=CC=C1)C(C2CCCCC2)N

Isomeric SMILES

CC(C)(C)OC(=O)[C@@H](CC1=CC=CC=C1)[C@H](C2CCCCC2)N

InChI

InChI=1S/C20H31NO2/c1-20(2,3)23-19(22)17(14-15-10-6-4-7-11-15)18(21)16-12-8-5-9-13-16/h4,6-7,10-11,16-18H,5,8-9,12-14,21H2,1-3H3/t17-,18-/m0/s1