3-[2-(4-bromophenyl)phenyl]-1-(2,6-dimethylpiperidin-1-yl)-2,3-dimethyl-butane-1,2-diol

Systemtic Name: 3-[2-(4-bromophenyl)phenyl]-1-(2,6-dimethylpiperidin-1-yl)-2,3-dimethyl-butane-1,2-diol Openeye Name: 3-[2-(4-bromophenyl)phenyl]-1-(2,6-dimethyl-1-piperidyl)-2,3-dimethyl-butane-1,2-diol CAS Name: 3-[2-(4-bromophenyl)phenyl]-1-(2,6-dimethyl-1-piperidinyl)-2,3-dimethylbutane-1,2-diol IUPAC Name: 3-[2-(4-bromophenyl)phenyl]-1-(2,6-dimethylpiperidin-1-yl)-2,3-dimethylbutane-1,2-diol Traditional Name: 3-[2-(4-bromophenyl)phenyl]-1-(2,6-dimethylpiperidino)-2,3-dimethyl-butane-1,2-diol Formula: C25H34BrNO2 MolecularWeight: 460.44696

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1C(C(C)(C(C)(C)C2=CC=CC=C2C3=CC=C(C=C3)Br)O)O)C

Isomeric SMILES

CC1CCCC(N1C(C(C)(C(C)(C)C2=CC=CC=C2C3=CC=C(C=C3)Br)O)O)C

InChI

InChI=1S/C25H34BrNO2/c1-17-9-8-10-18(2)27(17)23(28)25(5,29)24(3,4)22-12-7-6-11-21(22)19-13-15-20(26)16-14-19/h6-7,11-18,23,28-29H,8-10H2,1-5H3