[3-bromanyl-4-(2-methylpropoxy)phenyl]-[4-(diphenylmethyl)piperazin-1-yl]methanone

Systemtic Name: [3-bromanyl-4-(2-methylpropoxy)phenyl]-[4-(diphenylmethyl)piperazin-1-yl]methanone Openeye Name: (4-benzhydrylpiperazin-1-yl)-(3-bromo-4-isobutoxy-phenyl)methanone CAS Name: [3-bromo-4-(2-methylpropoxy)phenyl]-[4-(diphenylmethyl)-1-piperazinyl]methanone IUPAC Name: (4-benzhydrylpiperazin-1-yl)-[3-bromo-4-(2-methylpropoxy)phenyl]methanone Traditional Name: (4-benzhydrylpiperazino)-(3-bromo-4-isobutoxy-phenyl)methanone Formula: C28H31BrN2O2 MolecularWeight: 507.46194

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)Br

Isomeric SMILES

CC(C)COC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)Br

InChI

InChI=1S/C28H31BrN2O2/c1-21(2)20-33-26-14-13-24(19-25(26)29)28(32)31-17-15-30(16-18-31)27(22-9-5-3-6-10-22)23-11-7-4-8-12-23/h3-14,19,21,27H,15-18,20H2,1-2H3