(7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl (E)-3-(3-chloranyl-4,5-dimethoxy-phenyl)prop-2-enoate

Systemtic Name: (7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl (E)-3-(3-chloranyl-4,5-dimethoxy-phenyl)prop-2-enoate Openeye Name: (7-hydroxy-2-oxo-chromen-4-yl)methyl (E)-3-(3-chloro-4,5-dimethoxy-phenyl)prop-2-enoate CAS Name: (E)-3-(3-chloro-4,5-dimethoxyphenyl)-2-propenoic acid (7-hydroxy-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-hydroxy-2-oxochromen-4-yl)methyl (E)-3-(3-chloro-4,5-dimethoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(3-chloro-4,5-dimethoxy-phenyl)acrylic acid (7-hydroxy-2-keto-chromen-4-yl)methyl ester Formula: C21H17ClO7 MolecularWeight: 416.80848

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=CC(=O)OCC2=CC(=O)OC3=C2C=CC(=C3)O)Cl)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)/C=C/C(=O)OCC2=CC(=O)OC3=C2C=CC(=C3)O)Cl)OC

InChI

InChI=1S/C21H17ClO7/c1-26-18-8-12(7-16(22)21(18)27-2)3-6-19(24)28-11-13-9-20(25)29-17-10-14(23)4-5-15(13)17/h3-10,23H,11H2,1-2H3/b6-3+