3-(2,3-dimethylphenyl)-5-methyl-7-octadecan-2-yl-3H-1-benzofuran-2-one

Systemtic Name: 3-(2,3-dimethylphenyl)-5-methyl-7-octadecan-2-yl-3H-1-benzofuran-2-one Openeye Name: 3-(2,3-dimethylphenyl)-5-methyl-7-(1-methylheptadecyl)-3H-benzofuran-2-one CAS Name: 3-(2,3-dimethylphenyl)-5-methyl-7-octadecan-2-yl-3H-benzofuran-2-one IUPAC Name: 3-(2,3-dimethylphenyl)-5-methyl-7-octadecan-2-yl-3H-1-benzofuran-2-one Traditional Name: 3-(2,3-dimethylphenyl)-5-methyl-7-(1-methylheptadecyl)coumaran-2-one Formula: C35H52O2 MolecularWeight: 504.78618

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC(C)C1=C2C(=CC(=C1)C)C(C(=O)O2)C3=C(C(=CC=C3)C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCC(C)C1=C2C(=CC(=C1)C)C(C(=O)O2)C3=C(C(=CC=C3)C)C

InChI

InChI=1S/C35H52O2/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21-28(4)31-24-26(2)25-32-33(35(36)37-34(31)32)30-23-20-22-27(3)29(30)5/h20,22-25,28,33H,6-19,21H2,1-5H3