[(1R,2S)-2-tert-butylcyclohexyl] 3-[(diphenylmethyl)amino]butanoate

Systemtic Name: [(1R,2S)-2-tert-butylcyclohexyl] 3-[(diphenylmethyl)amino]butanoate Openeye Name: [(1R,2S)-2-tert-butylcyclohexyl] 3-(benzhydrylamino)butanoate CAS Name: 3-[(diphenylmethyl)amino]butanoic acid [(1R,2S)-2-tert-butylcyclohexyl] ester IUPAC Name: [(1R,2S)-2-tert-butylcyclohexyl] 3-(benzhydrylamino)butanoate Traditional Name: 3-(benzhydrylamino)butyric acid [(1R,2S)-2-tert-butylcyclohexyl] ester Formula: C27H37NO2 MolecularWeight: 407.58818

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)OC1CCCCC1C(C)(C)C)NC(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC(CC(=O)O[C@@H]1CCCC[C@H]1C(C)(C)C)NC(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C27H37NO2/c1-20(19-25(29)30-24-18-12-11-17-23(24)27(2,3)4)28-26(21-13-7-5-8-14-21)22-15-9-6-10-16-22/h5-10,13-16,20,23-24,26,28H,11-12,17-19H2,1-4H3/t20?,23-,24-/m1/s1