3-butyl-4-methyl-7-oxidanyl-chromen-2-one

Systemtic Name: 3-butyl-4-methyl-7-oxidanyl-chromen-2-one Openeye Name: 3-butyl-7-hydroxy-4-methyl-chromen-2-one CAS Name: 3-butyl-7-hydroxy-4-methyl-1-benzopyran-2-one IUPAC Name: 3-butyl-7-hydroxy-4-methylchromen-2-one Traditional Name: 3-butyl-7-hydroxy-4-methyl-coumarin Formula: C14H16O3 MolecularWeight: 232.27504

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C2=C(C=C(C=C2)O)OC1=O)C

Isomeric SMILES

CCCCC1=C(C2=C(C=C(C=C2)O)OC1=O)C

InChI

InChI=1S/C14H16O3/c1-3-4-5-12-9(2)11-7-6-10(15)8-13(11)17-14(12)16/h6-8,15H,3-5H2,1-2H3