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

Systemtic Name: ethyl 4-[4-[(2,6-dimethylphenyl)methoxy]phenyl]-4-oxidanylidene-butanoate Openeye Name: ethyl 4-[4-[(2,6-dimethylphenyl)methoxy]phenyl]-4-oxo-butanoate CAS Name: 4-[4-[(2,6-dimethylphenyl)methoxy]phenyl]-4-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-[4-[(2,6-dimethylphenyl)methoxy]phenyl]-4-oxobutanoate Traditional Name: 4-[4-(2,6-dimethylbenzyl)oxyphenyl]-4-keto-butyric acid ethyl ester Formula: C21H24O4 MolecularWeight: 340.41286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(=O)C1=CC=C(C=C1)OCC2=C(C=CC=C2C)C

Isomeric SMILES

CCOC(=O)CCC(=O)C1=CC=C(C=C1)OCC2=C(C=CC=C2C)C

InChI

InChI=1S/C21H24O4/c1-4-24-21(23)13-12-20(22)17-8-10-18(11-9-17)25-14-19-15(2)6-5-7-16(19)3/h5-11H,4,12-14H2,1-3H3