[3-oxidanylidene-2-[(3,4,5-trimethoxyphenyl)methylidene]-1-benzofuran-6-yl] 4-chloranylbutanoate

Systemtic Name: [3-oxidanylidene-2-[(3,4,5-trimethoxyphenyl)methylidene]-1-benzofuran-6-yl] 4-chloranylbutanoate Openeye Name: [3-oxo-2-[(3,4,5-trimethoxyphenyl)methylene]benzofuran-6-yl] 4-chlorobutanoate CAS Name: 4-chlorobutanoic acid [3-oxo-2-[(3,4,5-trimethoxyphenyl)methylidene]-6-benzofuranyl] ester IUPAC Name: [3-oxo-2-[(3,4,5-trimethoxyphenyl)methylidene]-1-benzofuran-6-yl] 4-chlorobutanoate Traditional Name: 4-chlorobutyric acid [3-keto-2-(3,4,5-trimethoxybenzylidene)coumaran-6-yl] ester Formula: C22H21ClO7 MolecularWeight: 432.85094

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C=C2C(=O)C3=C(O2)C=C(C=C3)OC(=O)CCCCl

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C=C2C(=O)C3=C(O2)C=C(C=C3)OC(=O)CCCCl

InChI

InChI=1S/C22H21ClO7/c1-26-18-10-13(11-19(27-2)22(18)28-3)9-17-21(25)15-7-6-14(12-16(15)30-17)29-20(24)5-4-8-23/h6-7,9-12H,4-5,8H2,1-3H3