(6-ethyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl (E)-3-(1,3-benzodioxol-5-yl)prop-2-enoate

Systemtic Name: (6-ethyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl (E)-3-(1,3-benzodioxol-5-yl)prop-2-enoate Openeye Name: (6-ethyl-7-hydroxy-2-oxo-chromen-4-yl)methyl (E)-3-(1,3-benzodioxol-5-yl)prop-2-enoate CAS Name: (E)-3-(1,3-benzodioxol-5-yl)-2-propenoic acid (6-ethyl-7-hydroxy-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (6-ethyl-7-hydroxy-2-oxochromen-4-yl)methyl (E)-3-(1,3-benzodioxol-5-yl)prop-2-enoate Traditional Name: (E)-3-(1,3-benzodioxol-5-yl)acrylic acid (6-ethyl-7-hydroxy-2-keto-chromen-4-yl)methyl ester Formula: C22H18O7 MolecularWeight: 394.37412

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)COC(=O)C=CC3=CC4=C(C=C3)OCO4)O

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)COC(=O)/C=C/C3=CC4=C(C=C3)OCO4)O

InChI

InChI=1S/C22H18O7/c1-2-14-8-16-15(9-22(25)29-19(16)10-17(14)23)11-26-21(24)6-4-13-3-5-18-20(7-13)28-12-27-18/h3-10,23H,2,11-12H2,1H3/b6-4+