ethyl 4-[5-azanyl-4-cyano-3-(dicyanomethylidene)-2-oxidanyl-furan-2-yl]-3,3-dimethyl-butanoate

Systemtic Name: ethyl 4-[5-azanyl-4-cyano-3-(dicyanomethylidene)-2-oxidanyl-furan-2-yl]-3,3-dimethyl-butanoate Openeye Name: ethyl 4-[5-amino-4-cyano-3-(dicyanomethylene)-2-hydroxy-2-furyl]-3,3-dimethyl-butanoate CAS Name: 4-[5-amino-4-cyano-3-(dicyanomethylidene)-2-hydroxy-2-furanyl]-3,3-dimethylbutanoic acid ethyl ester IUPAC Name: ethyl 4-[5-amino-4-cyano-3-(dicyanomethylidene)-2-hydroxyfuran-2-yl]-3,3-dimethylbutanoate Traditional Name: 4-[5-amino-4-cyano-3-(dicyanomethylene)-2-hydroxy-2-furyl]-3,3-dimethyl-butyric acid ethyl ester Formula: C16H18N4O4 MolecularWeight: 330.33852

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C)(C)CC1(C(=C(C#N)C#N)C(=C(O1)N)C#N)O

Isomeric SMILES

CCOC(=O)CC(C)(C)CC1(C(=C(C#N)C#N)C(=C(O1)N)C#N)O

InChI

InChI=1S/C16H18N4O4/c1-4-23-12(21)5-15(2,3)9-16(22)13(10(6-17)7-18)11(8-19)14(20)24-16/h22H,4-5,9,20H2,1-3H3