5-tert-butyl-3-(3,4-dimethylphenyl)-7-octadecan-2-yl-3H-1-benzofuran-2-one

Systemtic Name: 5-tert-butyl-3-(3,4-dimethylphenyl)-7-octadecan-2-yl-3H-1-benzofuran-2-one Openeye Name: 5-tert-butyl-3-(3,4-dimethylphenyl)-7-(1-methylheptadecyl)-3H-benzofuran-2-one CAS Name: 5-tert-butyl-3-(3,4-dimethylphenyl)-7-octadecan-2-yl-3H-benzofuran-2-one IUPAC Name: 5-tert-butyl-3-(3,4-dimethylphenyl)-7-octadecan-2-yl-3H-1-benzofuran-2-one Traditional Name: 5-tert-butyl-3-(3,4-dimethylphenyl)-7-(1-methylheptadecyl)coumaran-2-one Formula: C38H58O2 MolecularWeight: 546.86592

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C38H58O2/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-29(3)33-26-32(38(5,6)7)27-34-35(37(39)40-36(33)34)31-24-23-28(2)30(4)25-31/h23-27,29,35H,8-22H2,1-7H3