1-[4-(2-chloranyl-4-nitro-phenyl)piperazin-1-yl]propan-1-one

Systemtic Name: 1-[4-(2-chloranyl-4-nitro-phenyl)piperazin-1-yl]propan-1-one Openeye Name: 1-[4-(2-chloro-4-nitro-phenyl)piperazin-1-yl]propan-1-one CAS Name: 1-[4-(2-chloro-4-nitrophenyl)-1-piperazinyl]-1-propanone IUPAC Name: 1-[4-(2-chloro-4-nitrophenyl)piperazin-1-yl]propan-1-one Traditional Name: 1-[4-(2-chloro-4-nitro-phenyl)piperazino]propan-1-one Formula: C13H16ClN3O3 MolecularWeight: 297.73744

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])Cl

Isomeric SMILES

CCC(=O)N1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C13H16ClN3O3/c1-2-13(18)16-7-5-15(6-8-16)12-4-3-10(17(19)20)9-11(12)14/h3-4,9H,2,5-8H2,1H3