5-(3,3-dimethyl-2-oxidanylidene-butoxy)-4-ethyl-7-methyl-chromen-2-one

Systemtic Name: 5-(3,3-dimethyl-2-oxidanylidene-butoxy)-4-ethyl-7-methyl-chromen-2-one Openeye Name: 5-(3,3-dimethyl-2-oxo-butoxy)-4-ethyl-7-methyl-chromen-2-one CAS Name: 5-(3,3-dimethyl-2-oxobutoxy)-4-ethyl-7-methyl-1-benzopyran-2-one IUPAC Name: 5-(3,3-dimethyl-2-oxobutoxy)-4-ethyl-7-methylchromen-2-one Traditional Name: 4-ethyl-5-(2-keto-3,3-dimethyl-butoxy)-7-methyl-coumarin Formula: C18H22O4 MolecularWeight: 302.36488

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=O)OC2=C1C(=CC(=C2)C)OCC(=O)C(C)(C)C

Isomeric SMILES

CCC1=CC(=O)OC2=C1C(=CC(=C2)C)OCC(=O)C(C)(C)C

InChI

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