3-[(3-bromophenyl)methyl]-4-[(3,4-dimethoxyphenyl)methyl]oxolan-2-one

Systemtic Name: 3-[(3-bromophenyl)methyl]-4-[(3,4-dimethoxyphenyl)methyl]oxolan-2-one Openeye Name: 3-[(3-bromophenyl)methyl]-4-[(3,4-dimethoxyphenyl)methyl]tetrahydrofuran-2-one CAS Name: 3-[(3-bromophenyl)methyl]-4-[(3,4-dimethoxyphenyl)methyl]-2-oxolanone IUPAC Name: 3-[(3-bromophenyl)methyl]-4-[(3,4-dimethoxyphenyl)methyl]oxolan-2-one Traditional Name: 3-(3-bromobenzyl)-4-veratryl-tetrahydrofuran-2-one Formula: C20H21BrO4 MolecularWeight: 405.28234

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC2COC(=O)C2CC3=CC(=CC=C3)Br)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CC2COC(=O)C2CC3=CC(=CC=C3)Br)OC

InChI

InChI=1S/C20H21BrO4/c1-23-18-7-6-14(11-19(18)24-2)8-15-12-25-20(22)17(15)10-13-4-3-5-16(21)9-13/h3-7,9,11,15,17H,8,10,12H2,1-2H3