(4-bromophenyl)methyl 4-(3,4-dimethoxyphenyl)-4-oxidanylidene-butanoate

Systemtic Name: (4-bromophenyl)methyl 4-(3,4-dimethoxyphenyl)-4-oxidanylidene-butanoate Openeye Name: (4-bromophenyl)methyl 4-(3,4-dimethoxyphenyl)-4-oxo-butanoate CAS Name: 4-(3,4-dimethoxyphenyl)-4-oxobutanoic acid (4-bromophenyl)methyl ester IUPAC Name: (4-bromophenyl)methyl 4-(3,4-dimethoxyphenyl)-4-oxobutanoate Traditional Name: 4-(3,4-dimethoxyphenyl)-4-keto-butyric acid (4-bromobenzyl) ester Formula: C19H19BrO5 MolecularWeight: 407.25516

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)CCC(=O)OCC2=CC=C(C=C2)Br)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)CCC(=O)OCC2=CC=C(C=C2)Br)OC

InChI

InChI=1S/C19H19BrO5/c1-23-17-9-5-14(11-18(17)24-2)16(21)8-10-19(22)25-12-13-3-6-15(20)7-4-13/h3-7,9,11H,8,10,12H2,1-2H3