3,4,5-trimethoxy-2-(12-methyl-3-oxidanylidene-tridecyl)benzoate

Systemtic Name: 3,4,5-trimethoxy-2-(12-methyl-3-oxidanylidene-tridecyl)benzoate Openeye Name: 3,4,5-trimethoxy-2-(12-methyl-3-oxo-tridecyl)benzoate CAS Name: 3,4,5-trimethoxy-2-(12-methyl-3-oxotridecyl)benzoate IUPAC Name: 3,4,5-trimethoxy-2-(12-methyl-3-oxotridecyl)benzoate Traditional Name: 2-(3-keto-12-methyl-tridecyl)-3,4,5-trimethoxy-benzoate Formula: C24H37O6- MolecularWeight: 421.54698

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCCCCC(=O)CCC1=C(C(=C(C=C1C(=O)[O-])OC)OC)OC

Isomeric SMILES

CC(C)CCCCCCCCC(=O)CCC1=C(C(=C(C=C1C(=O)[O-])OC)OC)OC

InChI

InChI=1S/C24H38O6/c1-17(2)12-10-8-6-7-9-11-13-18(25)14-15-19-20(24(26)27)16-21(28-3)23(30-5)22(19)29-4/h16-17H,6-15H2,1-5H3,(H,26,27)/p-1