5-methyl-3-phenyl-7-tetradecan-2-yl-3H-1-benzofuran-2-one

Systemtic Name: 5-methyl-3-phenyl-7-tetradecan-2-yl-3H-1-benzofuran-2-one Openeye Name: 5-methyl-7-(1-methyltridecyl)-3-phenyl-3H-benzofuran-2-one CAS Name: 5-methyl-3-phenyl-7-tetradecan-2-yl-3H-benzofuran-2-one IUPAC Name: 5-methyl-3-phenyl-7-tetradecan-2-yl-3H-1-benzofuran-2-one Traditional Name: 5-methyl-7-(1-methyltridecyl)-3-phenyl-coumaran-2-one Formula: C29H40O2 MolecularWeight: 420.6267

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H40O2/c1-4-5-6-7-8-9-10-11-12-14-17-23(3)25-20-22(2)21-26-27(29(30)31-28(25)26)24-18-15-13-16-19-24/h13,15-16,18-21,23,27H,4-12,14,17H2,1-3H3