[3-(1-methylimidazol-2-yl)-2H-chromen-6-yl] 2,2-dimethyl-3-oxidanylidene-pentanoate

Systemtic Name: [3-(1-methylimidazol-2-yl)-2H-chromen-6-yl] 2,2-dimethyl-3-oxidanylidene-pentanoate Openeye Name: [3-(1-methylimidazol-2-yl)-2H-chromen-6-yl] 2,2-dimethyl-3-oxo-pentanoate CAS Name: 2,2-dimethyl-3-oxopentanoic acid [3-(1-methyl-2-imidazolyl)-2H-1-benzopyran-6-yl] ester IUPAC Name: [3-(1-methylimidazol-2-yl)-2H-chromen-6-yl] 2,2-dimethyl-3-oxopentanoate Traditional Name: 3-keto-2,2-dimethyl-valeric acid [3-(1-methylimidazol-2-yl)-2H-chromen-6-yl] ester Formula: C20H22N2O4 MolecularWeight: 354.39968

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C(C)(C)C(=O)OC1=CC2=C(C=C1)OCC(=C2)C3=NC=CN3C

Isomeric SMILES

CCC(=O)C(C)(C)C(=O)OC1=CC2=C(C=C1)OCC(=C2)C3=NC=CN3C

InChI

InChI=1S/C20H22N2O4/c1-5-17(23)20(2,3)19(24)26-15-6-7-16-13(11-15)10-14(12-25-16)18-21-8-9-22(18)4/h6-11H,5,12H2,1-4H3