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

Systemtic Name: 3-[4-[(2,6-dimethylphenyl)methoxy]phenyl]-4-oxidanylidene-butanoic acid Openeye Name: 3-[4-[(2,6-dimethylphenyl)methoxy]phenyl]-4-oxo-butanoic acid CAS Name: 3-[4-[(2,6-dimethylphenyl)methoxy]phenyl]-4-oxobutanoic acid IUPAC Name: 3-[4-[(2,6-dimethylphenyl)methoxy]phenyl]-4-oxobutanoic acid Traditional Name: 3-[4-(2,6-dimethylbenzyl)oxyphenyl]-4-keto-butyric acid Formula: C19H20O4 MolecularWeight: 312.3597

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)COC2=CC=C(C=C2)C(CC(=O)O)C=O

Isomeric SMILES

CC1=C(C(=CC=C1)C)COC2=CC=C(C=C2)C(CC(=O)O)C=O

InChI

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