7-hexadecan-2-yl-5-methyl-3-oxidanyl-3H-1-benzofuran-2-one

Systemtic Name: 7-hexadecan-2-yl-5-methyl-3-oxidanyl-3H-1-benzofuran-2-one Openeye Name: 3-hydroxy-5-methyl-7-(1-methylpentadecyl)-3H-benzofuran-2-one CAS Name: 7-hexadecan-2-yl-3-hydroxy-5-methyl-3H-benzofuran-2-one IUPAC Name: 7-hexadecan-2-yl-3-hydroxy-5-methyl-3H-1-benzofuran-2-one Traditional Name: 3-hydroxy-5-methyl-7-(1-methylpentadecyl)coumaran-2-one Formula: C25H40O3 MolecularWeight: 388.5833

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC(C)C1=C2C(=CC(=C1)C)C(C(=O)O2)O

Isomeric SMILES

CCCCCCCCCCCCCCC(C)C1=C2C(=CC(=C1)C)C(C(=O)O2)O

InChI

InChI=1S/C25H40O3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-20(3)21-17-19(2)18-22-23(26)25(27)28-24(21)22/h17-18,20,23,26H,4-16H2,1-3H3