2-chloranyl-N-[5,5-dimethyl-3-(4-nitrophenyl)-1,2,4-oxadiazol-4-yl]ethanamide

Systemtic Name: 2-chloranyl-N-[5,5-dimethyl-3-(4-nitrophenyl)-1,2,4-oxadiazol-4-yl]ethanamide Openeye Name: 2-chloro-N-[5,5-dimethyl-3-(4-nitrophenyl)-1,2,4-oxadiazol-4-yl]acetamide CAS Name: 2-chloro-N-[5,5-dimethyl-3-(4-nitrophenyl)-1,2,4-oxadiazol-4-yl]acetamide IUPAC Name: 2-chloro-N-[5,5-dimethyl-3-(4-nitrophenyl)-1,2,4-oxadiazol-4-yl]acetamide Traditional Name: 2-chloro-N-[5,5-dimethyl-3-(4-nitrophenyl)-1,2,4-oxadiazol-4-yl]acetamide Formula: C12H13ClN4O4 MolecularWeight: 312.70902

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Descriptors Computed from Structure

Canonical SMILES:

CC1(N(C(=NO1)C2=CC=C(C=C2)[N+](=O)[O-])NC(=O)CCl)C

Isomeric SMILES

CC1(N(C(=NO1)C2=CC=C(C=C2)[N+](=O)[O-])NC(=O)CCl)C

InChI

InChI=1S/C12H13ClN4O4/c1-12(2)16(14-10(18)7-13)11(15-21-12)8-3-5-9(6-4-8)17(19)20/h3-6H,7H2,1-2H3,(H,14,18)