3-hexyl-4,7-dimethyl-5-oxidanyl-chromen-2-one

Systemtic Name: 3-hexyl-4,7-dimethyl-5-oxidanyl-chromen-2-one Openeye Name: 3-hexyl-5-hydroxy-4,7-dimethyl-chromen-2-one CAS Name: 3-hexyl-5-hydroxy-4,7-dimethyl-1-benzopyran-2-one IUPAC Name: 3-hexyl-5-hydroxy-4,7-dimethylchromen-2-one Traditional Name: 3-hexyl-5-hydroxy-4,7-dimethyl-coumarin Formula: C17H22O3 MolecularWeight: 274.35478

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C2=C(C=C(C=C2O)C)OC1=O)C

Isomeric SMILES

CCCCCCC1=C(C2=C(C=C(C=C2O)C)OC1=O)C

InChI

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