3-methyl-2-propanoyl-benzoic acid

Systemtic Name: 3-methyl-2-propanoyl-benzoic acid Openeye Name: 3-methyl-2-propanoyl-benzoic acid CAS Name: 3-methyl-2-(1-oxopropyl)benzoic acid IUPAC Name: 3-methyl-2-propanoylbenzoic acid Traditional Name: 3-methyl-2-propionyl-benzoic acid Formula: C11H12O3 MolecularWeight: 192.21118

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=C(C=CC=C1C)C(=O)O

Isomeric SMILES

CCC(=O)C1=C(C=CC=C1C)C(=O)O

InChI

InChI=1S/C11H12O3/c1-3-9(12)10-7(2)5-4-6-8(10)11(13)14/h4-6H,3H2,1-2H3,(H,13,14)