dimethyl 2-(3-cyano-2-oxidanylidene-6-phenyl-pyran-4-yl)propanedioate

Systemtic Name: dimethyl 2-(3-cyano-2-oxidanylidene-6-phenyl-pyran-4-yl)propanedioate Openeye Name: dimethyl 2-(3-cyano-2-oxo-6-phenyl-pyran-4-yl)propanedioate CAS Name: 2-(3-cyano-2-oxo-6-phenyl-4-pyranyl)propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-(3-cyano-2-oxo-6-phenylpyran-4-yl)propanedioate Traditional Name: 2-(3-cyano-2-keto-6-phenyl-pyran-4-yl)malonic acid dimethyl ester Formula: C17H13NO6 MolecularWeight: 327.28822

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1=C(C(=O)OC(=C1)C2=CC=CC=C2)C#N)C(=O)OC

Isomeric SMILES

COC(=O)C(C1=C(C(=O)OC(=C1)C2=CC=CC=C2)C#N)C(=O)OC

InChI

InChI=1S/C17H13NO6/c1-22-16(20)14(17(21)23-2)11-8-13(10-6-4-3-5-7-10)24-15(19)12(11)9-18/h3-8,14H,1-2H3