3-(4-hexoxy-2-methyl-phenyl)carbonylbenzoic acid

Systemtic Name: 3-(4-hexoxy-2-methyl-phenyl)carbonylbenzoic acid Openeye Name: 3-(4-hexoxy-2-methyl-benzoyl)benzoic acid CAS Name: 3-[(4-hexoxy-2-methylphenyl)-oxomethyl]benzoic acid IUPAC Name: 3-(4-hexoxy-2-methylbenzoyl)benzoic acid Traditional Name: 3-(4-hexoxy-2-methyl-benzoyl)benzoic acid Formula: C21H24O4 MolecularWeight: 340.41286

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC(=C(C=C1)C(=O)C2=CC(=CC=C2)C(=O)O)C

Isomeric SMILES

CCCCCCOC1=CC(=C(C=C1)C(=O)C2=CC(=CC=C2)C(=O)O)C

InChI

InChI=1S/C21H24O4/c1-3-4-5-6-12-25-18-10-11-19(15(2)13-18)20(22)16-8-7-9-17(14-16)21(23)24/h7-11,13-14H,3-6,12H2,1-2H3,(H,23,24)