4-butyl-6-ethanoyl-8-methyl-7-oxidanyl-chromen-2-one

Systemtic Name: 4-butyl-6-ethanoyl-8-methyl-7-oxidanyl-chromen-2-one Openeye Name: 6-acetyl-4-butyl-7-hydroxy-8-methyl-chromen-2-one CAS Name: 6-acetyl-4-butyl-7-hydroxy-8-methyl-1-benzopyran-2-one IUPAC Name: 6-acetyl-4-butyl-7-hydroxy-8-methylchromen-2-one Traditional Name: 6-acetyl-4-butyl-7-hydroxy-8-methyl-coumarin Formula: C16H18O4 MolecularWeight: 274.31172

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=O)OC2=C(C(=C(C=C12)C(=O)C)O)C

Isomeric SMILES

CCCCC1=CC(=O)OC2=C(C(=C(C=C12)C(=O)C)O)C

InChI

InChI=1S/C16H18O4/c1-4-5-6-11-7-14(18)20-16-9(2)15(19)12(10(3)17)8-13(11)16/h7-8,19H,4-6H2,1-3H3