1-[4-(4-chloranyl-2-nitro-phenyl)piperazin-1-yl]-3-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)propan-1-one

Systemtic Name: 1-[4-(4-chloranyl-2-nitro-phenyl)piperazin-1-yl]-3-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)propan-1-one Openeye Name: 1-[4-(4-chloro-2-nitro-phenyl)piperazin-1-yl]-3-[3-(3-pyridyl)-1,2,4-oxadiazol-5-yl]propan-1-one CAS Name: 1-[4-(4-chloro-2-nitrophenyl)-1-piperazinyl]-3-[3-(3-pyridinyl)-1,2,4-oxadiazol-5-yl]-1-propanone IUPAC Name: 1-[4-(4-chloro-2-nitrophenyl)piperazin-1-yl]-3-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)propan-1-one Traditional Name: 1-[4-(4-chloro-2-nitro-phenyl)piperazino]-3-[3-(3-pyridyl)-1,2,4-oxadiazol-5-yl]propan-1-one Formula: C20H19ClN6O4 MolecularWeight: 442.85566

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=C(C=C2)Cl)[N+](=O)[O-])C(=O)CCC3=NC(=NO3)C4=CN=CC=C4

Isomeric SMILES

C1CN(CCN1C2=C(C=C(C=C2)Cl)[N+](=O)[O-])C(=O)CCC3=NC(=NO3)C4=CN=CC=C4

InChI

InChI=1S/C20H19ClN6O4/c21-15-3-4-16(17(12-15)27(29)30)25-8-10-26(11-9-25)19(28)6-5-18-23-20(24-31-18)14-2-1-7-22-13-14/h1-4,7,12-13H,5-6,8-11H2