[3-(1,3-benzodioxol-5-yl)-4-methyl-2-oxidanylidene-chromen-6-yl] 3,4,5-trimethoxybenzoate

Systemtic Name: [3-(1,3-benzodioxol-5-yl)-4-methyl-2-oxidanylidene-chromen-6-yl] 3,4,5-trimethoxybenzoate Openeye Name: [3-(1,3-benzodioxol-5-yl)-4-methyl-2-oxo-chromen-6-yl] 3,4,5-trimethoxybenzoate CAS Name: 3,4,5-trimethoxybenzoic acid [3-(1,3-benzodioxol-5-yl)-4-methyl-2-oxo-1-benzopyran-6-yl] ester IUPAC Name: [3-(1,3-benzodioxol-5-yl)-4-methyl-2-oxochromen-6-yl] 3,4,5-trimethoxybenzoate Traditional Name: 3,4,5-trimethoxybenzoic acid [3-(1,3-benzodioxol-5-yl)-2-keto-4-methyl-chromen-6-yl] ester Formula: C27H22O9 MolecularWeight: 490.45818

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=C(C=C2)OC(=O)C3=CC(=C(C(=C3)OC)OC)OC)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=C(C=C2)OC(=O)C3=CC(=C(C(=C3)OC)OC)OC)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C27H22O9/c1-14-18-12-17(35-26(28)16-10-22(30-2)25(32-4)23(11-16)31-3)6-8-19(18)36-27(29)24(14)15-5-7-20-21(9-15)34-13-33-20/h5-12H,13H2,1-4H3