7-(3,3-dimethyl-2-oxidanylidene-butoxy)-3-ethyl-4-methyl-chromen-2-one

Systemtic Name: 7-(3,3-dimethyl-2-oxidanylidene-butoxy)-3-ethyl-4-methyl-chromen-2-one Openeye Name: 7-(3,3-dimethyl-2-oxo-butoxy)-3-ethyl-4-methyl-chromen-2-one CAS Name: 7-(3,3-dimethyl-2-oxobutoxy)-3-ethyl-4-methyl-1-benzopyran-2-one IUPAC Name: 7-(3,3-dimethyl-2-oxobutoxy)-3-ethyl-4-methylchromen-2-one Traditional Name: 3-ethyl-7-(2-keto-3,3-dimethyl-butoxy)-4-methyl-coumarin Formula: C18H22O4 MolecularWeight: 302.36488

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=C(C=C(C=C2)OCC(=O)C(C)(C)C)OC1=O)C

Isomeric SMILES

CCC1=C(C2=C(C=C(C=C2)OCC(=O)C(C)(C)C)OC1=O)C

InChI

InChI=1S/C18H22O4/c1-6-13-11(2)14-8-7-12(9-15(14)22-17(13)20)21-10-16(19)18(3,4)5/h7-9H,6,10H2,1-5H3