2-(4-decoxyphenyl)carbonylbenzoic acid; ethanoic acid

Systemtic Name: 2-(4-decoxyphenyl)carbonylbenzoic acid; ethanoic acid Openeye Name: acetic acid; 2-(4-decoxybenzoyl)benzoic acid CAS Name: acetic acid; 2-[(4-decoxyphenyl)-oxomethyl]benzoic acid IUPAC Name: acetic acid; 2-(4-decoxybenzoyl)benzoic acid Traditional Name: acetic acid; 2-(4-decoxybenzoyl)benzoic acid Formula: C26H34O6 MolecularWeight: 442.54456

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC=C(C=C1)C(=O)C2=CC=CC=C2C(=O)O.CC(=O)O

Isomeric SMILES

CCCCCCCCCCOC1=CC=C(C=C1)C(=O)C2=CC=CC=C2C(=O)O.CC(=O)O

InChI

InChI=1S/C24H30O4.C2H4O2/c1-2-3-4-5-6-7-8-11-18-28-20-16-14-19(15-17-20)23(25)21-12-9-10-13-22(21)24(26)27;1-2(3)4/h9-10,12-17H,2-8,11,18H2,1H3,(H,26,27);1H3,(H,3,4)