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

Systemtic Name: [4-(2-chloranyl-4-nitro-phenyl)-2-methyl-piperazin-1-yl]-(3-methylfuran-2-yl)methanone Openeye Name: [4-(2-chloro-4-nitro-phenyl)-2-methyl-piperazin-1-yl]-(3-methyl-2-furyl)methanone CAS Name: [4-(2-chloro-4-nitrophenyl)-2-methyl-1-piperazinyl]-(3-methyl-2-furanyl)methanone IUPAC Name: [4-(2-chloro-4-nitrophenyl)-2-methylpiperazin-1-yl]-(3-methylfuran-2-yl)methanone Traditional Name: [4-(2-chloro-4-nitro-phenyl)-2-methyl-piperazino]-(3-methyl-2-furyl)methanone Formula: C17H18ClN3O4 MolecularWeight: 363.79552

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)C2=C(C=CO2)C)C3=C(C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CC1CN(CCN1C(=O)C2=C(C=CO2)C)C3=C(C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C17H18ClN3O4/c1-11-5-8-25-16(11)17(22)20-7-6-19(10-12(20)2)15-4-3-13(21(23)24)9-14(15)18/h3-5,8-9,12H,6-7,10H2,1-2H3