2-(5-tert-butyl-1-benzofuran-3-yl)-1-[4-(diphenylmethyl)piperazin-1-yl]ethanone

Systemtic Name: 2-(5-tert-butyl-1-benzofuran-3-yl)-1-[4-(diphenylmethyl)piperazin-1-yl]ethanone Openeye Name: 1-(4-benzhydrylpiperazin-1-yl)-2-(5-tert-butylbenzofuran-3-yl)ethanone CAS Name: 2-(5-tert-butyl-3-benzofuranyl)-1-[4-(diphenylmethyl)-1-piperazinyl]ethanone IUPAC Name: 1-(4-benzhydrylpiperazin-1-yl)-2-(5-tert-butyl-1-benzofuran-3-yl)ethanone Traditional Name: 1-(4-benzhydrylpiperazino)-2-(5-tert-butylbenzofuran-3-yl)ethanone Formula: C31H34N2O2 MolecularWeight: 466.61386

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2=C(C=C1)OC=C2CC(=O)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC(C)(C)C1=CC2=C(C=C1)OC=C2CC(=O)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C31H34N2O2/c1-31(2,3)26-14-15-28-27(21-26)25(22-35-28)20-29(34)32-16-18-33(19-17-32)30(23-10-6-4-7-11-23)24-12-8-5-9-13-24/h4-15,21-22,30H,16-20H2,1-3H3