(6-chloranyl-7-methyl-2-oxidanylidene-chromen-4-yl)methyl 3-(3,5-dimethoxyphenyl)propanoate

Systemtic Name: (6-chloranyl-7-methyl-2-oxidanylidene-chromen-4-yl)methyl 3-(3,5-dimethoxyphenyl)propanoate Openeye Name: (6-chloro-7-methyl-2-oxo-chromen-4-yl)methyl 3-(3,5-dimethoxyphenyl)propanoate CAS Name: 3-(3,5-dimethoxyphenyl)propanoic acid (6-chloro-7-methyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (6-chloro-7-methyl-2-oxochromen-4-yl)methyl 3-(3,5-dimethoxyphenyl)propanoate Traditional Name: 3-(3,5-dimethoxyphenyl)propionic acid (6-chloro-2-keto-7-methyl-chromen-4-yl)methyl ester Formula: C22H21ClO6 MolecularWeight: 416.85154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)CCC3=CC(=CC(=C3)OC)OC)Cl

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)CCC3=CC(=CC(=C3)OC)OC)Cl

InChI

InChI=1S/C22H21ClO6/c1-13-6-20-18(11-19(13)23)15(9-22(25)29-20)12-28-21(24)5-4-14-7-16(26-2)10-17(8-14)27-3/h6-11H,4-5,12H2,1-3H3