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

Systemtic Name: [4-(4-chloranyl-2-nitro-phenyl)piperazin-1-yl]-(3,5-dimethoxyphenyl)methanone Openeye Name: [4-(4-chloro-2-nitro-phenyl)piperazin-1-yl]-(3,5-dimethoxyphenyl)methanone CAS Name: [4-(4-chloro-2-nitrophenyl)-1-piperazinyl]-(3,5-dimethoxyphenyl)methanone IUPAC Name: [4-(4-chloro-2-nitrophenyl)piperazin-1-yl]-(3,5-dimethoxyphenyl)methanone Traditional Name: [4-(4-chloro-2-nitro-phenyl)piperazino]-(3,5-dimethoxyphenyl)methanone Formula: C19H20ClN3O5 MolecularWeight: 405.8322

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)Cl)[N+](=O)[O-])OC

Isomeric SMILES

COC1=CC(=CC(=C1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)Cl)[N+](=O)[O-])OC

InChI

InChI=1S/C19H20ClN3O5/c1-27-15-9-13(10-16(12-15)28-2)19(24)22-7-5-21(6-8-22)17-4-3-14(20)11-18(17)23(25)26/h3-4,9-12H,5-8H2,1-2H3