2-(6-bromanyl-2-methoxy-naphthalen-1-yl)-1-[4-(diphenylmethyl)piperazin-1-yl]ethanone

Systemtic Name: 2-(6-bromanyl-2-methoxy-naphthalen-1-yl)-1-[4-(diphenylmethyl)piperazin-1-yl]ethanone Openeye Name: 1-(4-benzhydrylpiperazin-1-yl)-2-(6-bromo-2-methoxy-1-naphthyl)ethanone CAS Name: 2-(6-bromo-2-methoxy-1-naphthalenyl)-1-[4-(diphenylmethyl)-1-piperazinyl]ethanone IUPAC Name: 1-(4-benzhydrylpiperazin-1-yl)-2-(6-bromo-2-methoxynaphthalen-1-yl)ethanone Traditional Name: 1-(4-benzhydrylpiperazino)-2-(6-bromo-2-methoxy-1-naphthyl)ethanone Formula: C30H29BrN2O2 MolecularWeight: 529.46746

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C1)C=C(C=C2)Br)CC(=O)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

COC1=C(C2=C(C=C1)C=C(C=C2)Br)CC(=O)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C30H29BrN2O2/c1-35-28-15-12-24-20-25(31)13-14-26(24)27(28)21-29(34)32-16-18-33(19-17-32)30(22-8-4-2-5-9-22)23-10-6-3-7-11-23/h2-15,20,30H,16-19,21H2,1H3