(1S)-1-(4-bromophenyl)-2-[4-(2,5-dimethylphenyl)piperazin-1-yl]ethanol

Systemtic Name: (1S)-1-(4-bromophenyl)-2-[4-(2,5-dimethylphenyl)piperazin-1-yl]ethanol Openeye Name: (1S)-1-(4-bromophenyl)-2-[4-(2,5-dimethylphenyl)piperazin-1-yl]ethanol CAS Name: (1S)-1-(4-bromophenyl)-2-[4-(2,5-dimethylphenyl)-1-piperazinyl]ethanol IUPAC Name: (1S)-1-(4-bromophenyl)-2-[4-(2,5-dimethylphenyl)piperazin-1-yl]ethanol Traditional Name: (1S)-1-(4-bromophenyl)-2-[4-(2,5-dimethylphenyl)piperazino]ethanol Formula: C20H25BrN2O MolecularWeight: 389.3293

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2CCN(CC2)CC(C3=CC=C(C=C3)Br)O

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2CCN(CC2)C[C@H](C3=CC=C(C=C3)Br)O

InChI

InChI=1S/C20H25BrN2O/c1-15-3-4-16(2)19(13-15)23-11-9-22(10-12-23)14-20(24)17-5-7-18(21)8-6-17/h3-8,13,20,24H,9-12,14H2,1-2H3/t20-/m1/s1