methyl 4-(4-ethanoyl-8-oxidanyl-tridecyl)benzoate

Systemtic Name: methyl 4-(4-ethanoyl-8-oxidanyl-tridecyl)benzoate Openeye Name: methyl 4-(4-acetyl-8-hydroxy-tridecyl)benzoate CAS Name: 4-(4-acetyl-8-hydroxytridecyl)benzoic acid methyl ester IUPAC Name: methyl 4-(4-acetyl-8-hydroxytridecyl)benzoate Traditional Name: 4-(4-acetyl-8-hydroxy-tridecyl)benzoic acid methyl ester Formula: C23H36O4 MolecularWeight: 376.52954

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CCCC(CCCC1=CC=C(C=C1)C(=O)OC)C(=O)C)O

Isomeric SMILES

CCCCCC(CCCC(CCCC1=CC=C(C=C1)C(=O)OC)C(=O)C)O

InChI

InChI=1S/C23H36O4/c1-4-5-6-12-22(25)13-8-11-20(18(2)24)10-7-9-19-14-16-21(17-15-19)23(26)27-3/h14-17,20,22,25H,4-13H2,1-3H3