2-(4-pentan-2-ylphenyl)carbonylbenzoic acid

Systemtic Name: 2-(4-pentan-2-ylphenyl)carbonylbenzoic acid Openeye Name: 2-[4-(1-methylbutyl)benzoyl]benzoic acid CAS Name: 2-[oxo-(4-pentan-2-ylphenyl)methyl]benzoic acid IUPAC Name: 2-(4-pentan-2-ylbenzoyl)benzoic acid Traditional Name: 2-[4-(1-methylbutyl)benzoyl]benzoic acid Formula: C19H20O3 MolecularWeight: 296.3603

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20O3/c1-3-6-13(2)14-9-11-15(12-10-14)18(20)16-7-4-5-8-17(16)19(21)22/h4-5,7-13H,3,6H2,1-2H3,(H,21,22)