4,6,7-trimethyl-3-(4-octadecoxyphenyl)-5-oxidanyl-3H-1-benzofuran-2-one

Systemtic Name: 4,6,7-trimethyl-3-(4-octadecoxyphenyl)-5-oxidanyl-3H-1-benzofuran-2-one Openeye Name: 5-hydroxy-4,6,7-trimethyl-3-(4-octadecoxyphenyl)-3H-benzofuran-2-one CAS Name: 5-hydroxy-4,6,7-trimethyl-3-(4-octadecoxyphenyl)-3H-benzofuran-2-one IUPAC Name: 5-hydroxy-4,6,7-trimethyl-3-(4-octadecoxyphenyl)-3H-1-benzofuran-2-one Traditional Name: 5-hydroxy-4,6,7-trimethyl-3-(4-stearyloxyphenyl)coumaran-2-one Formula: C35H52O4 MolecularWeight: 536.78498

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC1=CC=C(C=C1)C2C3=C(C(=C(C(=C3OC2=O)C)C)O)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC1=CC=C(C=C1)C2C3=C(C(=C(C(=C3OC2=O)C)C)O)C

InChI

InChI=1S/C35H52O4/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-25-38-30-23-21-29(22-24-30)32-31-28(4)33(36)26(2)27(3)34(31)39-35(32)37/h21-24,32,36H,5-20,25H2,1-4H3