2-[2-bromanyl-3,5-bis(methoxymethoxy)-6-phenyl-phenyl]-1-[4-(phenylmethyl)piperazin-1-yl]ethanone

Systemtic Name: 2-[2-bromanyl-3,5-bis(methoxymethoxy)-6-phenyl-phenyl]-1-[4-(phenylmethyl)piperazin-1-yl]ethanone Openeye Name: 1-(4-benzylpiperazin-1-yl)-2-[2-bromo-3,5-bis(methoxymethoxy)-6-phenyl-phenyl]ethanone CAS Name: 2-[2-bromo-3,5-bis(methoxymethoxy)-6-phenylphenyl]-1-[4-(phenylmethyl)-1-piperazinyl]ethanone IUPAC Name: 1-(4-benzylpiperazin-1-yl)-2-[2-bromo-3,5-bis(methoxymethoxy)-6-phenylphenyl]ethanone Traditional Name: 1-(4-benzylpiperazino)-2-[2-bromo-3,5-bis(methoxymethoxy)-6-phenyl-phenyl]ethanone Formula: C29H33BrN2O5 MolecularWeight: 569.48672

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Descriptors Computed from Structure

Canonical SMILES:

COCOC1=CC(=C(C(=C1C2=CC=CC=C2)CC(=O)N3CCN(CC3)CC4=CC=CC=C4)Br)OCOC

Isomeric SMILES

COCOC1=CC(=C(C(=C1C2=CC=CC=C2)CC(=O)N3CCN(CC3)CC4=CC=CC=C4)Br)OCOC

InChI

InChI=1S/C29H33BrN2O5/c1-34-20-36-25-18-26(37-21-35-2)29(30)24(28(25)23-11-7-4-8-12-23)17-27(33)32-15-13-31(14-16-32)19-22-9-5-3-6-10-22/h3-12,18H,13-17,19-21H2,1-2H3