tert-butyl 4-[4-[(3-bromophenyl)methyl]piperidin-1-yl]-4-methyl-piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-[(3-bromophenyl)methyl]piperidin-1-yl]-4-methyl-piperidine-1-carboxylate Openeye Name: tert-butyl 4-[4-[(3-bromophenyl)methyl]-1-piperidyl]-4-methyl-piperidine-1-carboxylate CAS Name: 4-[4-[(3-bromophenyl)methyl]-1-piperidinyl]-4-methyl-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-[(3-bromophenyl)methyl]piperidin-1-yl]-4-methylpiperidine-1-carboxylate Traditional Name: 4-[4-(3-bromobenzyl)piperidino]-4-methyl-piperidine-1-carboxylic acid tert-butyl ester Formula: C23H35BrN2O2 MolecularWeight: 451.4402

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCN(CC1)C(=O)OC(C)(C)C)N2CCC(CC2)CC3=CC(=CC=C3)Br

Isomeric SMILES

CC1(CCN(CC1)C(=O)OC(C)(C)C)N2CCC(CC2)CC3=CC(=CC=C3)Br

InChI

InChI=1S/C23H35BrN2O2/c1-22(2,3)28-21(27)25-14-10-23(4,11-15-25)26-12-8-18(9-13-26)16-19-6-5-7-20(24)17-19/h5-7,17-18H,8-16H2,1-4H3