potassium 4-[3-[(2,6-dimethylphenyl)methoxy]phenyl]-4-oxidanylidene-butanoate

Systemtic Name: potassium 4-[3-[(2,6-dimethylphenyl)methoxy]phenyl]-4-oxidanylidene-butanoate Openeye Name: potassium 4-[3-[(2,6-dimethylphenyl)methoxy]phenyl]-4-oxo-butanoate CAS Name: potassium 4-[3-[(2,6-dimethylphenyl)methoxy]phenyl]-4-oxobutanoate IUPAC Name: potassium 4-[3-[(2,6-dimethylphenyl)methoxy]phenyl]-4-oxobutanoate Traditional Name: potassium 4-[3-(2,6-dimethylbenzyl)oxyphenyl]-4-keto-butyrate Formula: C19H19KO4 MolecularWeight: 350.45006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)COC2=CC=CC(=C2)C(=O)CCC(=O)[O-].[K+]

Isomeric SMILES

CC1=C(C(=CC=C1)C)COC2=CC=CC(=C2)C(=O)CCC(=O)[O-].[K+]

InChI

InChI=1S/C19H20O4.K/c1-13-5-3-6-14(2)17(13)12-23-16-8-4-7-15(11-16)18(20)9-10-19(21)22;/h3-8,11H,9-10,12H2,1-2H3,(H,21,22);/q;+1/p-1