3-hexyl-4,8-dimethyl-7-(2-oxidanylidenepropoxy)chromen-2-one

Systemtic Name: 3-hexyl-4,8-dimethyl-7-(2-oxidanylidenepropoxy)chromen-2-one Openeye Name: 7-acetonyloxy-3-hexyl-4,8-dimethyl-chromen-2-one CAS Name: 3-hexyl-4,8-dimethyl-7-(2-oxopropoxy)-1-benzopyran-2-one IUPAC Name: 3-hexyl-4,8-dimethyl-7-(2-oxopropoxy)chromen-2-one Traditional Name: 7-acetonyloxy-3-hexyl-4,8-dimethyl-coumarin Formula: C20H26O4 MolecularWeight: 330.41804

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H26O4/c1-5-6-7-8-9-17-14(3)16-10-11-18(23-12-13(2)21)15(4)19(16)24-20(17)22/h10-11H,5-9,12H2,1-4H3