dimethyl 2-(4-cyano-3,4-dihydro-2H-chromen-3-yl)propanedioate

Systemtic Name: dimethyl 2-(4-cyano-3,4-dihydro-2H-chromen-3-yl)propanedioate Openeye Name: dimethyl 2-(4-cyanochroman-3-yl)propanedioate CAS Name: 2-(4-cyano-3,4-dihydro-2H-1-benzopyran-3-yl)propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-(4-cyano-3,4-dihydro-2H-chromen-3-yl)propanedioate Traditional Name: 2-(4-cyanochroman-3-yl)malonic acid dimethyl ester Formula: C15H15NO5 MolecularWeight: 289.2833

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1COC2=CC=CC=C2C1C#N)C(=O)OC

Isomeric SMILES

COC(=O)C(C1COC2=CC=CC=C2C1C#N)C(=O)OC

InChI

InChI=1S/C15H15NO5/c1-19-14(17)13(15(18)20-2)11-8-21-12-6-4-3-5-9(12)10(11)7-16/h3-6,10-11,13H,8H2,1-2H3