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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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