3-[2-(3,3-dimethyl-2-oxidanylidene-butyl)phenyl]propanoic acid

Systemtic Name: 3-[2-(3,3-dimethyl-2-oxidanylidene-butyl)phenyl]propanoic acid Openeye Name: 3-[2-(3,3-dimethyl-2-oxo-butyl)phenyl]propanoic acid CAS Name: 3-[2-(3,3-dimethyl-2-oxobutyl)phenyl]propanoic acid IUPAC Name: 3-[2-(3,3-dimethyl-2-oxobutyl)phenyl]propanoic acid Traditional Name: 3-[2-(2-keto-3,3-dimethyl-butyl)phenyl]propionic acid Formula: C15H20O3 MolecularWeight: 248.3175

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)CC1=CC=CC=C1CCC(=O)O

Isomeric SMILES

CC(C)(C)C(=O)CC1=CC=CC=C1CCC(=O)O

InChI

InChI=1S/C15H20O3/c1-15(2,3)13(16)10-12-7-5-4-6-11(12)8-9-14(17)18/h4-7H,8-10H2,1-3H3,(H,17,18)