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

Systemtic Name: (8-methyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl (E)-3-(1,3-benzodioxol-5-yl)prop-2-enoate Openeye Name: (7-hydroxy-8-methyl-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 (7-hydroxy-8-methyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-hydroxy-8-methyl-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 (7-hydroxy-2-keto-8-methyl-chromen-4-yl)methyl ester Formula: C21H16O7 MolecularWeight: 380.34754

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1OC(=O)C=C2COC(=O)C=CC3=CC4=C(C=C3)OCO4)O

Isomeric SMILES

CC1=C(C=CC2=C1OC(=O)C=C2COC(=O)/C=C/C3=CC4=C(C=C3)OCO4)O

InChI

InChI=1S/C21H16O7/c1-12-16(22)5-4-15-14(9-20(24)28-21(12)15)10-25-19(23)7-3-13-2-6-17-18(8-13)27-11-26-17/h2-9,22H,10-11H2,1H3/b7-3+