tert-butyl 2-[(2R,4S)-2-[2-(4-methylphenyl)propan-2-yl]piperidin-4-yl]ethanoate

Systemtic Name: tert-butyl 2-[(2R,4S)-2-[2-(4-methylphenyl)propan-2-yl]piperidin-4-yl]ethanoate Openeye Name: tert-butyl 2-[(2R,4S)-2-[1-methyl-1-(p-tolyl)ethyl]-4-piperidyl]acetate CAS Name: 2-[(2R,4S)-2-[2-(4-methylphenyl)propan-2-yl]-4-piperidinyl]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[(2R,4S)-2-[2-(4-methylphenyl)propan-2-yl]piperidin-4-yl]acetate Traditional Name: 2-[(2R,4S)-2-[1-methyl-1-(p-tolyl)ethyl]-4-piperidyl]acetic acid tert-butyl ester Formula: C21H33NO2 MolecularWeight: 331.49222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C)(C)C2CC(CCN2)CC(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(C)(C)[C@H]2C[C@H](CCN2)CC(=O)OC(C)(C)C

InChI

InChI=1S/C21H33NO2/c1-15-7-9-17(10-8-15)21(5,6)18-13-16(11-12-22-18)14-19(23)24-20(2,3)4/h7-10,16,18,22H,11-14H2,1-6H3/t16-,18+/m0/s1