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

Systemtic Name: 5-tert-butyl-7-hexadecan-2-yl-3-oxidanyl-3H-1-benzofuran-2-one Openeye Name: 5-tert-butyl-3-hydroxy-7-(1-methylpentadecyl)-3H-benzofuran-2-one CAS Name: 5-tert-butyl-7-hexadecan-2-yl-3-hydroxy-3H-benzofuran-2-one IUPAC Name: 5-tert-butyl-7-hexadecan-2-yl-3-hydroxy-3H-1-benzofuran-2-one Traditional Name: 5-tert-butyl-3-hydroxy-7-(1-methylpentadecyl)coumaran-2-one Formula: C28H46O3 MolecularWeight: 430.66304

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H46O3/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-21(2)23-19-22(28(3,4)5)20-24-25(29)27(30)31-26(23)24/h19-21,25,29H,6-18H2,1-5H3