3-hexyl-7-methoxy-4-methyl-chromen-2-one

Systemtic Name: 3-hexyl-7-methoxy-4-methyl-chromen-2-one Openeye Name: 3-hexyl-7-methoxy-4-methyl-chromen-2-one CAS Name: 3-hexyl-7-methoxy-4-methyl-1-benzopyran-2-one IUPAC Name: 3-hexyl-7-methoxy-4-methylchromen-2-one Traditional Name: 3-hexyl-7-methoxy-4-methyl-coumarin Formula: C17H22O3 MolecularWeight: 274.35478

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C2=C(C=C(C=C2)OC)OC1=O)C

Isomeric SMILES

CCCCCCC1=C(C2=C(C=C(C=C2)OC)OC1=O)C

InChI

InChI=1S/C17H22O3/c1-4-5-6-7-8-15-12(2)14-10-9-13(19-3)11-16(14)20-17(15)18/h9-11H,4-8H2,1-3H3