(8-methyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl 3-(3,4-dimethoxyphenyl)propanoate

Systemtic Name: (8-methyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl 3-(3,4-dimethoxyphenyl)propanoate Openeye Name: (7-hydroxy-8-methyl-2-oxo-chromen-4-yl)methyl 3-(3,4-dimethoxyphenyl)propanoate CAS Name: 3-(3,4-dimethoxyphenyl)propanoic acid (7-hydroxy-8-methyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-hydroxy-8-methyl-2-oxochromen-4-yl)methyl 3-(3,4-dimethoxyphenyl)propanoate Traditional Name: 3-(3,4-dimethoxyphenyl)propionic acid (7-hydroxy-2-keto-8-methyl-chromen-4-yl)methyl ester Formula: C22H22O7 MolecularWeight: 398.40588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1OC(=O)C=C2COC(=O)CCC3=CC(=C(C=C3)OC)OC)O

Isomeric SMILES

CC1=C(C=CC2=C1OC(=O)C=C2COC(=O)CCC3=CC(=C(C=C3)OC)OC)O

InChI

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