3-(4-heptylphenyl)carbonylbenzoic acid

Systemtic Name: 3-(4-heptylphenyl)carbonylbenzoic acid Openeye Name: 3-(4-heptylbenzoyl)benzoic acid CAS Name: 3-[(4-heptylphenyl)-oxomethyl]benzoic acid IUPAC Name: 3-(4-heptylbenzoyl)benzoic acid Traditional Name: 3-(4-heptylbenzoyl)benzoic acid Formula: C21H24O3 MolecularWeight: 324.41346

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)C(=O)C2=CC(=CC=C2)C(=O)O

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)C(=O)C2=CC(=CC=C2)C(=O)O

InChI

InChI=1S/C21H24O3/c1-2-3-4-5-6-8-16-11-13-17(14-12-16)20(22)18-9-7-10-19(15-18)21(23)24/h7,9-15H,2-6,8H2,1H3,(H,23,24)