dimethyl (2E)-3-(1,3-benzodioxol-5-yl)-2-[(4-methoxyphenyl)methylidene]pentanedioate

Systemtic Name: dimethyl (2E)-3-(1,3-benzodioxol-5-yl)-2-[(4-methoxyphenyl)methylidene]pentanedioate Openeye Name: dimethyl (2E)-3-(1,3-benzodioxol-5-yl)-2-[(4-methoxyphenyl)methylene]pentanedioate CAS Name: (2E)-3-(1,3-benzodioxol-5-yl)-2-[(4-methoxyphenyl)methylidene]pentanedioic acid dimethyl ester IUPAC Name: dimethyl (2E)-3-(1,3-benzodioxol-5-yl)-2-[(4-methoxyphenyl)methylidene]pentanedioate Traditional Name: (2E)-3-(1,3-benzodioxol-5-yl)-2-p-anisylidene-glutaric acid dimethyl ester Formula: C22H22O7 MolecularWeight: 398.40588

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C=C(C(CC(=O)OC)C2=CC3=C(C=C2)OCO3)C(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)/C=C(\C(CC(=O)OC)C2=CC3=C(C=C2)OCO3)/C(=O)OC

InChI

InChI=1S/C22H22O7/c1-25-16-7-4-14(5-8-16)10-18(22(24)27-3)17(12-21(23)26-2)15-6-9-19-20(11-15)29-13-28-19/h4-11,17H,12-13H2,1-3H3/b18-10+