2-(4-methylphenyl)carbonylheptanoic acid

Systemtic Name: 2-(4-methylphenyl)carbonylheptanoic acid Openeye Name: 2-(4-methylbenzoyl)heptanoic acid CAS Name: 2-[(4-methylphenyl)-oxomethyl]heptanoic acid IUPAC Name: 2-(4-methylbenzoyl)heptanoic acid Traditional Name: 2-p-toluoylenanthic acid Formula: C15H20O3 MolecularWeight: 248.3175

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C(=O)C1=CC=C(C=C1)C)C(=O)O

Isomeric SMILES

CCCCCC(C(=O)C1=CC=C(C=C1)C)C(=O)O

InChI

InChI=1S/C15H20O3/c1-3-4-5-6-13(15(17)18)14(16)12-9-7-11(2)8-10-12/h7-10,13H,3-6H2,1-2H3,(H,17,18)