2-(4-heptanoylphenyl)benzoic acid

Systemtic Name: 2-(4-heptanoylphenyl)benzoic acid Openeye Name: 2-(4-heptanoylphenyl)benzoic acid CAS Name: 2-[4-(1-oxoheptyl)phenyl]benzoic acid IUPAC Name: 2-(4-heptanoylphenyl)benzoic acid Traditional Name: 2-(4-enanthylphenyl)benzoic acid Formula: C20H22O3 MolecularWeight: 310.38688

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)C1=CC=C(C=C1)C2=CC=CC=C2C(=O)O

Isomeric SMILES

CCCCCCC(=O)C1=CC=C(C=C1)C2=CC=CC=C2C(=O)O

InChI

InChI=1S/C20H22O3/c1-2-3-4-5-10-19(21)16-13-11-15(12-14-16)17-8-6-7-9-18(17)20(22)23/h6-9,11-14H,2-5,10H2,1H3,(H,22,23)