[(2S,4S,5S)-2,5-dimethyl-1-propan-2-yl-piperidin-4-yl] benzoate

Systemtic Name: [(2S,4S,5S)-2,5-dimethyl-1-propan-2-yl-piperidin-4-yl] benzoate Openeye Name: [(2S,4S,5S)-1-isopropyl-2,5-dimethyl-4-piperidyl] benzoate CAS Name: benzoic acid [(2S,4S,5S)-2,5-dimethyl-1-propan-2-yl-4-piperidinyl] ester IUPAC Name: [(2S,4S,5S)-2,5-dimethyl-1-propan-2-ylpiperidin-4-yl] benzoate Traditional Name: benzoic acid [(2S,4S,5S)-1-isopropyl-2,5-dimethyl-4-piperidyl] ester Formula: C17H25NO2 MolecularWeight: 275.3859

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C(CN1C(C)C)C)OC(=O)C2=CC=CC=C2

Isomeric SMILES

C[C@H]1C[C@@H]([C@H](CN1C(C)C)C)OC(=O)C2=CC=CC=C2

InChI

InChI=1S/C17H25NO2/c1-12(2)18-11-13(3)16(10-14(18)4)20-17(19)15-8-6-5-7-9-15/h5-9,12-14,16H,10-11H2,1-4H3/t13-,14-,16-/m0/s1