1-[4-(2-chloranyl-4-nitro-phenyl)carbonyl-3-methyl-piperazin-1-yl]-2-(5-phenyl-1,2,4-oxadiazol-3-yl)ethanone

Systemtic Name: 1-[4-(2-chloranyl-4-nitro-phenyl)carbonyl-3-methyl-piperazin-1-yl]-2-(5-phenyl-1,2,4-oxadiazol-3-yl)ethanone Openeye Name: 1-[4-(2-chloro-4-nitro-benzoyl)-3-methyl-piperazin-1-yl]-2-(5-phenyl-1,2,4-oxadiazol-3-yl)ethanone CAS Name: 1-[4-[(2-chloro-4-nitrophenyl)-oxomethyl]-3-methyl-1-piperazinyl]-2-(5-phenyl-1,2,4-oxadiazol-3-yl)ethanone IUPAC Name: 1-[4-(2-chloro-4-nitrobenzoyl)-3-methylpiperazin-1-yl]-2-(5-phenyl-1,2,4-oxadiazol-3-yl)ethanone Traditional Name: 1-[4-(2-chloro-4-nitro-benzoyl)-3-methyl-piperazino]-2-(5-phenyl-1,2,4-oxadiazol-3-yl)ethanone Formula: C22H20ClN5O5 MolecularWeight: 469.8777

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl)C(=O)CC3=NOC(=N3)C4=CC=CC=C4

Isomeric SMILES

CC1CN(CCN1C(=O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl)C(=O)CC3=NOC(=N3)C4=CC=CC=C4

InChI

InChI=1S/C22H20ClN5O5/c1-14-13-26(20(29)12-19-24-21(33-25-19)15-5-3-2-4-6-15)9-10-27(14)22(30)17-8-7-16(28(31)32)11-18(17)23/h2-8,11,14H,9-10,12-13H2,1H3