tert-butyl (1R,2R)-2-[[(1R)-1-phenylethyl]-(phenylmethyl)amino]cyclohexane-1-carboxylate

Systemtic Name: tert-butyl (1R,2R)-2-[[(1R)-1-phenylethyl]-(phenylmethyl)amino]cyclohexane-1-carboxylate Openeye Name: tert-butyl (1R,2R)-2-[benzyl-[(1R)-1-phenylethyl]amino]cyclohexanecarboxylate CAS Name: (1R,2R)-2-[[(1R)-1-phenylethyl]-(phenylmethyl)amino]-1-cyclohexanecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (1R,2R)-2-[benzyl-[(1R)-1-phenylethyl]amino]cyclohexane-1-carboxylate Traditional Name: (1R,2R)-2-[benzyl-[(1R)-1-phenylethyl]amino]cyclohexanecarboxylic acid tert-butyl ester Formula: C26H35NO2 MolecularWeight: 393.5616

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N(CC2=CC=CC=C2)C3CCCCC3C(=O)OC(C)(C)C

Isomeric SMILES

C[C@H](C1=CC=CC=C1)N(CC2=CC=CC=C2)[C@@H]3CCCC[C@H]3C(=O)OC(C)(C)C

InChI

InChI=1S/C26H35NO2/c1-20(22-15-9-6-10-16-22)27(19-21-13-7-5-8-14-21)24-18-12-11-17-23(24)25(28)29-26(2,3)4/h5-10,13-16,20,23-24H,11-12,17-19H2,1-4H3/t20-,23-,24-/m1/s1