3-heptanoyl-2-hexyl-5-oxidanyl-chromen-4-one

Systemtic Name: 3-heptanoyl-2-hexyl-5-oxidanyl-chromen-4-one Openeye Name: 3-heptanoyl-2-hexyl-5-hydroxy-chromen-4-one CAS Name: 2-hexyl-5-hydroxy-3-(1-oxoheptyl)-1-benzopyran-4-one IUPAC Name: 3-heptanoyl-2-hexyl-5-hydroxychromen-4-one Traditional Name: 3-enanthyl-2-hexyl-5-hydroxy-chromone Formula: C22H30O4 MolecularWeight: 358.4712

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C(=O)C2=C(O1)C=CC=C2O)C(=O)CCCCCC

Isomeric SMILES

CCCCCCC1=C(C(=O)C2=C(O1)C=CC=C2O)C(=O)CCCCCC

InChI

InChI=1S/C22H30O4/c1-3-5-7-9-12-16(23)20-18(14-10-8-6-4-2)26-19-15-11-13-17(24)21(19)22(20)25/h11,13,15,24H,3-10,12,14H2,1-2H3