(5-chloranyl-3-methyl-1-benzofuran-2-yl)-[4-(4-chloranyl-2-nitro-phenyl)piperazin-1-yl]methanone

Systemtic Name: (5-chloranyl-3-methyl-1-benzofuran-2-yl)-[4-(4-chloranyl-2-nitro-phenyl)piperazin-1-yl]methanone Openeye Name: (5-chloro-3-methyl-benzofuran-2-yl)-[4-(4-chloro-2-nitro-phenyl)piperazin-1-yl]methanone CAS Name: (5-chloro-3-methyl-2-benzofuranyl)-[4-(4-chloro-2-nitrophenyl)-1-piperazinyl]methanone IUPAC Name: (5-chloro-3-methyl-1-benzofuran-2-yl)-[4-(4-chloro-2-nitrophenyl)piperazin-1-yl]methanone Traditional Name: (5-chloro-3-methyl-benzofuran-2-yl)-[4-(4-chloro-2-nitro-phenyl)piperazino]methanone Formula: C20H17Cl2N3O4 MolecularWeight: 434.27268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C=C(C=C2)Cl)C(=O)N3CCN(CC3)C4=C(C=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=C(OC2=C1C=C(C=C2)Cl)C(=O)N3CCN(CC3)C4=C(C=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C20H17Cl2N3O4/c1-12-15-10-13(21)3-5-18(15)29-19(12)20(26)24-8-6-23(7-9-24)16-4-2-14(22)11-17(16)25(27)28/h2-5,10-11H,6-9H2,1H3