ethyl 4-[5-[(Z)-(3-cyano-4,6-dimethyl-2-oxidanylidene-pyridin-1-yl)iminomethyl]furan-2-yl]benzoate

Systemtic Name: ethyl 4-[5-[(Z)-(3-cyano-4,6-dimethyl-2-oxidanylidene-pyridin-1-yl)iminomethyl]furan-2-yl]benzoate Openeye Name: ethyl 4-[5-[(Z)-(3-cyano-4,6-dimethyl-2-oxo-1-pyridyl)iminomethyl]-2-furyl]benzoate CAS Name: 4-[5-[(Z)-(3-cyano-4,6-dimethyl-2-oxo-1-pyridinyl)iminomethyl]-2-furanyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[5-[(Z)-(3-cyano-4,6-dimethyl-2-oxopyridin-1-yl)iminomethyl]furan-2-yl]benzoate Traditional Name: 4-[5-[(Z)-(3-cyano-2-keto-4,6-dimethyl-1-pyridyl)iminomethyl]-2-furyl]benzoic acid ethyl ester Formula: C22H19N3O4 MolecularWeight: 389.40396

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)C2=CC=C(O2)C=NN3C(=CC(=C(C3=O)C#N)C)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)C2=CC=C(O2)/C=N\N3C(=CC(=C(C3=O)C#N)C)C

InChI

InChI=1S/C22H19N3O4/c1-4-28-22(27)17-7-5-16(6-8-17)20-10-9-18(29-20)13-24-25-15(3)11-14(2)19(12-23)21(25)26/h5-11,13H,4H2,1-3H3/b24-13-