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

Systemtic Name: ethyl (2E)-2-cyano-2-[3-(3-nitrophenyl)-2H-1,2,4-oxadiazol-5-ylidene]ethanoate Openeye Name: ethyl (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 ethyl ester IUPAC Name: ethyl (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 ethyl ester Formula: C13H10N4O5 MolecularWeight: 302.2423

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H10N4O5/c1-2-21-13(18)10(7-14)12-15-11(16-22-12)8-4-3-5-9(6-8)17(19)20/h3-6H,2H2,1H3,(H,15,16)/b12-10+