2-(6-methyl-1-benzofuran-3-yl)-1-[4-(4-nitrophenyl)piperazin-1-yl]ethanone

Systemtic Name: 2-(6-methyl-1-benzofuran-3-yl)-1-[4-(4-nitrophenyl)piperazin-1-yl]ethanone Openeye Name: 2-(6-methylbenzofuran-3-yl)-1-[4-(4-nitrophenyl)piperazin-1-yl]ethanone CAS Name: 2-(6-methyl-3-benzofuranyl)-1-[4-(4-nitrophenyl)-1-piperazinyl]ethanone IUPAC Name: 2-(6-methyl-1-benzofuran-3-yl)-1-[4-(4-nitrophenyl)piperazin-1-yl]ethanone Traditional Name: 2-(6-methylbenzofuran-3-yl)-1-[4-(4-nitrophenyl)piperazino]ethanone Formula: C21H21N3O4 MolecularWeight: 379.40914

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=CO2)CC(=O)N3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC2=C(C=C1)C(=CO2)CC(=O)N3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H21N3O4/c1-15-2-7-19-16(14-28-20(19)12-15)13-21(25)23-10-8-22(9-11-23)17-3-5-18(6-4-17)24(26)27/h2-7,12,14H,8-11,13H2,1H3