6-butanoyl-4-methyl-5-oxidanyl-chromen-2-one

Systemtic Name: 6-butanoyl-4-methyl-5-oxidanyl-chromen-2-one Openeye Name: 6-butanoyl-5-hydroxy-4-methyl-chromen-2-one CAS Name: 5-hydroxy-4-methyl-6-(1-oxobutyl)-1-benzopyran-2-one IUPAC Name: 6-butanoyl-5-hydroxy-4-methylchromen-2-one Traditional Name: 6-butyryl-5-hydroxy-4-methyl-coumarin Formula: C14H14O4 MolecularWeight: 246.25856

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=C(C2=C(C=C1)OC(=O)C=C2C)O

Isomeric SMILES

CCCC(=O)C1=C(C2=C(C=C1)OC(=O)C=C2C)O

InChI

InChI=1S/C14H14O4/c1-3-4-10(15)9-5-6-11-13(14(9)17)8(2)7-12(16)18-11/h5-7,17H,3-4H2,1-2H3