3,5-diethyl-4-methyl-chromen-2-one

Systemtic Name: 3,5-diethyl-4-methyl-chromen-2-one Openeye Name: 3,5-diethyl-4-methyl-chromen-2-one CAS Name: 3,5-diethyl-4-methyl-1-benzopyran-2-one IUPAC Name: 3,5-diethyl-4-methylchromen-2-one Traditional Name: 3,5-diethyl-4-methyl-coumarin Formula: C14H16O2 MolecularWeight: 216.27564

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C(=C(C(=O)OC2=CC=C1)CC)C

Isomeric SMILES

CCC1=C2C(=C(C(=O)OC2=CC=C1)CC)C

InChI

InChI=1S/C14H16O2/c1-4-10-7-6-8-12-13(10)9(3)11(5-2)14(15)16-12/h6-8H,4-5H2,1-3H3