4-oxidanylidene-5-(2,4,6-trimethylphenyl)pentanoic acid

Systemtic Name: 4-oxidanylidene-5-(2,4,6-trimethylphenyl)pentanoic acid Openeye Name: 4-oxo-5-(2,4,6-trimethylphenyl)pentanoic acid CAS Name: 4-oxo-5-(2,4,6-trimethylphenyl)pentanoic acid IUPAC Name: 4-oxo-5-(2,4,6-trimethylphenyl)pentanoic acid Traditional Name: 4-keto-5-mesityl-valeric acid Formula: C14H18O3 MolecularWeight: 234.29092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)CC(=O)CCC(=O)O)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)CC(=O)CCC(=O)O)C

InChI

InChI=1S/C14H18O3/c1-9-6-10(2)13(11(3)7-9)8-12(15)4-5-14(16)17/h6-7H,4-5,8H2,1-3H3,(H,16,17)