tert-butyl 2-[(1R,2S,3S)-2-azanyl-3-phenyl-cyclohexyl]ethanoate

Systemtic Name: tert-butyl 2-[(1R,2S,3S)-2-azanyl-3-phenyl-cyclohexyl]ethanoate Openeye Name: tert-butyl 2-[(1R,2S,3S)-2-amino-3-phenyl-cyclohexyl]acetate CAS Name: 2-[(1R,2S,3S)-2-amino-3-phenylcyclohexyl]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[(1R,2S,3S)-2-amino-3-phenylcyclohexyl]acetate Traditional Name: 2-[(1R,2S,3S)-2-amino-3-phenyl-cyclohexyl]acetic acid tert-butyl ester Formula: C18H27NO2 MolecularWeight: 289.41248

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CC1CCCC(C1N)C2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)C[C@H]1CCC[C@H]([C@H]1N)C2=CC=CC=C2

InChI

InChI=1S/C18H27NO2/c1-18(2,3)21-16(20)12-14-10-7-11-15(17(14)19)13-8-5-4-6-9-13/h4-6,8-9,14-15,17H,7,10-12,19H2,1-3H3/t14-,15+,17+/m1/s1