ethyl 4-(3-cyano-4-oxidanylidene-2,3-dihydrochromen-2-yl)-3-oxidanylidene-hexanoate

Systemtic Name: ethyl 4-(3-cyano-4-oxidanylidene-2,3-dihydrochromen-2-yl)-3-oxidanylidene-hexanoate Openeye Name: ethyl 4-(3-cyano-4-oxo-chroman-2-yl)-3-oxo-hexanoate CAS Name: 4-(3-cyano-4-oxo-3,4-dihydro-2H-1-benzopyran-2-yl)-3-oxohexanoic acid ethyl ester IUPAC Name: ethyl 4-(3-cyano-4-oxo-2,3-dihydrochromen-2-yl)-3-oxohexanoate Traditional Name: 4-(3-cyano-4-keto-chroman-2-yl)-3-keto-hexanoic acid ethyl ester Formula: C18H19NO5 MolecularWeight: 329.34716

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1C(C(=O)C2=CC=CC=C2O1)C#N)C(=O)CC(=O)OCC

Isomeric SMILES

CCC(C1C(C(=O)C2=CC=CC=C2O1)C#N)C(=O)CC(=O)OCC

InChI

InChI=1S/C18H19NO5/c1-3-11(14(20)9-16(21)23-4-2)18-13(10-19)17(22)12-7-5-6-8-15(12)24-18/h5-8,11,13,18H,3-4,9H2,1-2H3