4-(1-methoxy-2-methyl-1-oxidanylidene-propan-2-yl)benzoic acid

Systemtic Name: 4-(1-methoxy-2-methyl-1-oxidanylidene-propan-2-yl)benzoic acid Openeye Name: 4-(2-methoxy-1,1-dimethyl-2-oxo-ethyl)benzoic acid CAS Name: 4-(1-methoxy-2-methyl-1-oxopropan-2-yl)benzoic acid IUPAC Name: 4-(1-methoxy-2-methyl-1-oxopropan-2-yl)benzoic acid Traditional Name: 4-(2-keto-2-methoxy-1,1-dimethyl-ethyl)benzoic acid Formula: C12H14O4 MolecularWeight: 222.23716

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=C(C=C1)C(=O)O)C(=O)OC

Isomeric SMILES

CC(C)(C1=CC=C(C=C1)C(=O)O)C(=O)OC

InChI

InChI=1S/C12H14O4/c1-12(2,11(15)16-3)9-6-4-8(5-7-9)10(13)14/h4-7H,1-3H3,(H,13,14)