methyl 4-(3-cyano-4-oxidanylidene-2,3-dihydrochromen-2-yl)-3-oxidanylidene-pentanoate

Systemtic Name: methyl 4-(3-cyano-4-oxidanylidene-2,3-dihydrochromen-2-yl)-3-oxidanylidene-pentanoate Openeye Name: methyl 4-(3-cyano-4-oxo-chroman-2-yl)-3-oxo-pentanoate CAS Name: 4-(3-cyano-4-oxo-3,4-dihydro-2H-1-benzopyran-2-yl)-3-oxopentanoic acid methyl ester IUPAC Name: methyl 4-(3-cyano-4-oxo-2,3-dihydrochromen-2-yl)-3-oxopentanoate Traditional Name: 4-(3-cyano-4-keto-chroman-2-yl)-3-keto-valeric acid methyl ester Formula: C16H15NO5 MolecularWeight: 301.294

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1C(C(=O)C2=CC=CC=C2O1)C#N)C(=O)CC(=O)OC

Isomeric SMILES

CC(C1C(C(=O)C2=CC=CC=C2O1)C#N)C(=O)CC(=O)OC

InChI

InChI=1S/C16H15NO5/c1-9(12(18)7-14(19)21-2)16-11(8-17)15(20)10-5-3-4-6-13(10)22-16/h3-6,9,11,16H,7H2,1-2H3