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

Systemtic Name: [4-(4-chloranyl-2-nitro-phenyl)piperazin-1-yl]-(3-methyl-1-benzofuran-2-yl)methanone Openeye Name: [4-(4-chloro-2-nitro-phenyl)piperazin-1-yl]-(3-methylbenzofuran-2-yl)methanone CAS Name: [4-(4-chloro-2-nitrophenyl)-1-piperazinyl]-(3-methyl-2-benzofuranyl)methanone IUPAC Name: [4-(4-chloro-2-nitrophenyl)piperazin-1-yl]-(3-methyl-1-benzofuran-2-yl)methanone Traditional Name: [4-(4-chloro-2-nitro-phenyl)piperazino]-(3-methylbenzofuran-2-yl)methanone Formula: C20H18ClN3O4 MolecularWeight: 399.82762

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=CC=CC=C12)C(=O)N3CCN(CC3)C4=C(C=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=C(OC2=CC=CC=C12)C(=O)N3CCN(CC3)C4=C(C=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C20H18ClN3O4/c1-13-15-4-2-3-5-18(15)28-19(13)20(25)23-10-8-22(9-11-23)16-7-6-14(21)12-17(16)24(26)27/h2-7,12H,8-11H2,1H3