4-[3-(2,6-dimethylphenyl)carbonyloxyphenyl]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[3-(2,6-dimethylphenyl)carbonyloxyphenyl]-4-oxidanylidene-butanoic acid Openeye Name: 4-[3-(2,6-dimethylbenzoyl)oxyphenyl]-4-oxo-butanoic acid CAS Name: 4-[3-[(2,6-dimethylphenyl)-oxomethoxy]phenyl]-4-oxobutanoic acid IUPAC Name: 4-[3-(2,6-dimethylbenzoyl)oxyphenyl]-4-oxobutanoic acid Traditional Name: 4-[3-(2,6-dimethylbenzoyl)oxyphenyl]-4-keto-butyric acid Formula: C19H18O5 MolecularWeight: 326.34322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)C(=O)OC2=CC=CC(=C2)C(=O)CCC(=O)O

Isomeric SMILES

CC1=C(C(=CC=C1)C)C(=O)OC2=CC=CC(=C2)C(=O)CCC(=O)O

InChI

InChI=1S/C19H18O5/c1-12-5-3-6-13(2)18(12)19(23)24-15-8-4-7-14(11-15)16(20)9-10-17(21)22/h3-8,11H,9-10H2,1-2H3,(H,21,22)