ethyl 2-(3-azanyl-2-cyano-4-nitro-phenyl)-2-methyl-3-oxidanylidene-butanoate

Systemtic Name: ethyl 2-(3-azanyl-2-cyano-4-nitro-phenyl)-2-methyl-3-oxidanylidene-butanoate Openeye Name: ethyl 2-(3-amino-2-cyano-4-nitro-phenyl)-2-methyl-3-oxo-butanoate CAS Name: 2-(3-amino-2-cyano-4-nitrophenyl)-2-methyl-3-oxobutanoic acid ethyl ester IUPAC Name: ethyl 2-(3-amino-2-cyano-4-nitrophenyl)-2-methyl-3-oxobutanoate Traditional Name: 2-(3-amino-2-cyano-4-nitro-phenyl)-3-keto-2-methyl-butyric acid ethyl ester Formula: C14H15N3O5 MolecularWeight: 305.286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)(C1=C(C(=C(C=C1)[N+](=O)[O-])N)C#N)C(=O)C

Isomeric SMILES

CCOC(=O)C(C)(C1=C(C(=C(C=C1)[N+](=O)[O-])N)C#N)C(=O)C

InChI

InChI=1S/C14H15N3O5/c1-4-22-13(19)14(3,8(2)18)10-5-6-11(17(20)21)12(16)9(10)7-15/h5-6H,4,16H2,1-3H3