(3-methoxyphenyl)-[4-[[5-(4-methylphenyl)-1-benzofuran-2-yl]methyl]piperazin-1-yl]methanone

Systemtic Name: (3-methoxyphenyl)-[4-[[5-(4-methylphenyl)-1-benzofuran-2-yl]methyl]piperazin-1-yl]methanone Openeye Name: (3-methoxyphenyl)-[4-[[5-(p-tolyl)benzofuran-2-yl]methyl]piperazin-1-yl]methanone CAS Name: (3-methoxyphenyl)-[4-[[5-(4-methylphenyl)-2-benzofuranyl]methyl]-1-piperazinyl]methanone IUPAC Name: (3-methoxyphenyl)-[4-[[5-(4-methylphenyl)-1-benzofuran-2-yl]methyl]piperazin-1-yl]methanone Traditional Name: (3-methoxyphenyl)-[4-[[5-(p-tolyl)benzofuran-2-yl]methyl]piperazino]methanone Formula: C28H28N2O3 MolecularWeight: 440.53352

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC3=C(C=C2)OC(=C3)CN4CCN(CC4)C(=O)C5=CC(=CC=C5)OC

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC3=C(C=C2)OC(=C3)CN4CCN(CC4)C(=O)C5=CC(=CC=C5)OC

InChI

InChI=1S/C28H28N2O3/c1-20-6-8-21(9-7-20)22-10-11-27-24(16-22)18-26(33-27)19-29-12-14-30(15-13-29)28(31)23-4-3-5-25(17-23)32-2/h3-11,16-18H,12-15,19H2,1-2H3