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

Systemtic Name: [4-(4-chloranyl-2-nitro-phenyl)piperazin-1-yl]-(3,5-dimethoxy-4-methyl-phenyl)methanone Openeye Name: [4-(4-chloro-2-nitro-phenyl)piperazin-1-yl]-(3,5-dimethoxy-4-methyl-phenyl)methanone CAS Name: [4-(4-chloro-2-nitrophenyl)-1-piperazinyl]-(3,5-dimethoxy-4-methylphenyl)methanone IUPAC Name: [4-(4-chloro-2-nitrophenyl)piperazin-1-yl]-(3,5-dimethoxy-4-methylphenyl)methanone Traditional Name: [4-(4-chloro-2-nitro-phenyl)piperazino]-(3,5-dimethoxy-4-methyl-phenyl)methanone Formula: C20H22ClN3O5 MolecularWeight: 419.85878

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1OC)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)Cl)[N+](=O)[O-])OC

Isomeric SMILES

CC1=C(C=C(C=C1OC)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)Cl)[N+](=O)[O-])OC

InChI

InChI=1S/C20H22ClN3O5/c1-13-18(28-2)10-14(11-19(13)29-3)20(25)23-8-6-22(7-9-23)16-5-4-15(21)12-17(16)24(26)27/h4-5,10-12H,6-9H2,1-3H3