methyl 2-[5-[(E)-2-cyano-2-(4-oxidanylidene-1H-quinazolin-2-yl)ethenyl]furan-2-yl]benzoate

Systemtic Name: methyl 2-[5-[(E)-2-cyano-2-(4-oxidanylidene-1H-quinazolin-2-yl)ethenyl]furan-2-yl]benzoate Openeye Name: methyl 2-[5-[(E)-2-cyano-2-(4-oxo-1H-quinazolin-2-yl)vinyl]-2-furyl]benzoate CAS Name: 2-[5-[(E)-2-cyano-2-(4-oxo-1H-quinazolin-2-yl)ethenyl]-2-furanyl]benzoic acid methyl ester IUPAC Name: methyl 2-[5-[(E)-2-cyano-2-(4-oxo-1H-quinazolin-2-yl)ethenyl]furan-2-yl]benzoate Traditional Name: 2-[5-[(E)-2-cyano-2-(4-keto-1H-quinazolin-2-yl)vinyl]-2-furyl]benzoic acid methyl ester Formula: C23H15N3O4 MolecularWeight: 397.3829

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1C2=CC=C(O2)C=C(C#N)C3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

COC(=O)C1=CC=CC=C1C2=CC=C(O2)/C=C(\C#N)/C3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C23H15N3O4/c1-29-23(28)17-7-3-2-6-16(17)20-11-10-15(30-20)12-14(13-24)21-25-19-9-5-4-8-18(19)22(27)26-21/h2-12H,1H3,(H,25,26,27)/b14-12+