[4-(2-chloranyl-6-nitro-phenyl)piperazin-1-yl]-(2-methyl-5-phenyl-furan-3-yl)methanone

Systemtic Name: [4-(2-chloranyl-6-nitro-phenyl)piperazin-1-yl]-(2-methyl-5-phenyl-furan-3-yl)methanone Openeye Name: [4-(2-chloro-6-nitro-phenyl)piperazin-1-yl]-(2-methyl-5-phenyl-3-furyl)methanone CAS Name: [4-(2-chloro-6-nitrophenyl)-1-piperazinyl]-(2-methyl-5-phenyl-3-furanyl)methanone IUPAC Name: [4-(2-chloro-6-nitrophenyl)piperazin-1-yl]-(2-methyl-5-phenylfuran-3-yl)methanone Traditional Name: [4-(2-chloro-6-nitro-phenyl)piperazino]-(2-methyl-5-phenyl-3-furyl)methanone Formula: C22H20ClN3O4 MolecularWeight: 425.8649

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)C2=CC=CC=C2)C(=O)N3CCN(CC3)C4=C(C=CC=C4Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(O1)C2=CC=CC=C2)C(=O)N3CCN(CC3)C4=C(C=CC=C4Cl)[N+](=O)[O-]

InChI

InChI=1S/C22H20ClN3O4/c1-15-17(14-20(30-15)16-6-3-2-4-7-16)22(27)25-12-10-24(11-13-25)21-18(23)8-5-9-19(21)26(28)29/h2-9,14H,10-13H2,1H3