methyl (2E)-2-cyano-2-[3-(3-nitrophenyl)-2H-1,2,4-oxadiazol-5-ylidene]ethanoate

Systemtic Name: methyl (2E)-2-cyano-2-[3-(3-nitrophenyl)-2H-1,2,4-oxadiazol-5-ylidene]ethanoate Openeye Name: methyl (2E)-2-cyano-2-[3-(3-nitrophenyl)-2H-1,2,4-oxadiazol-5-ylidene]acetate CAS Name: (2E)-2-cyano-2-[3-(3-nitrophenyl)-2H-1,2,4-oxadiazol-5-ylidene]acetic acid methyl ester IUPAC Name: methyl (2E)-2-cyano-2-[3-(3-nitrophenyl)-2H-1,2,4-oxadiazol-5-ylidene]acetate Traditional Name: (2E)-2-cyano-2-[3-(3-nitrophenyl)-2H-1,2,4-oxadiazol-5-ylidene]acetic acid methyl ester Formula: C12H8N4O5 MolecularWeight: 288.21572

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=C1N=C(NO1)C2=CC(=CC=C2)[N+](=O)[O-])C#N

Isomeric SMILES

COC(=O)/C(=C/1\N=C(NO1)C2=CC(=CC=C2)[N+](=O)[O-])/C#N

InChI

InChI=1S/C12H8N4O5/c1-20-12(17)9(6-13)11-14-10(15-21-11)7-3-2-4-8(5-7)16(18)19/h2-5H,1H3,(H,14,15)/b11-9+