5-hexyl-3-(3-methoxyphenyl)-3H-2-benzofuran-1-one

Systemtic Name: 5-hexyl-3-(3-methoxyphenyl)-3H-2-benzofuran-1-one Openeye Name: 5-hexyl-3-(3-methoxyphenyl)-3H-isobenzofuran-1-one CAS Name: 5-hexyl-3-(3-methoxyphenyl)-3H-isobenzofuran-1-one IUPAC Name: 5-hexyl-3-(3-methoxyphenyl)-3H-2-benzofuran-1-one Traditional Name: 5-hexyl-3-(3-methoxyphenyl)phthalide Formula: C21H24O3 MolecularWeight: 324.41346

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC2=C(C=C1)C(=O)OC2C3=CC(=CC=C3)OC

Isomeric SMILES

CCCCCCC1=CC2=C(C=C1)C(=O)OC2C3=CC(=CC=C3)OC

InChI

InChI=1S/C21H24O3/c1-3-4-5-6-8-15-11-12-18-19(13-15)20(24-21(18)22)16-9-7-10-17(14-16)23-2/h7,9-14,20H,3-6,8H2,1-2H3