[3-(1,3-benzodioxol-5-yl)-2-oxidanylidene-chromen-7-yl] 3,4,5-trimethoxybenzoate

Systemtic Name: [3-(1,3-benzodioxol-5-yl)-2-oxidanylidene-chromen-7-yl] 3,4,5-trimethoxybenzoate Openeye Name: [3-(1,3-benzodioxol-5-yl)-2-oxo-chromen-7-yl] 3,4,5-trimethoxybenzoate CAS Name: 3,4,5-trimethoxybenzoic acid [3-(1,3-benzodioxol-5-yl)-2-oxo-1-benzopyran-7-yl] ester IUPAC Name: [3-(1,3-benzodioxol-5-yl)-2-oxochromen-7-yl] 3,4,5-trimethoxybenzoate Traditional Name: 3,4,5-trimethoxybenzoic acid [3-(1,3-benzodioxol-5-yl)-2-keto-chromen-7-yl] ester Formula: C26H20O9 MolecularWeight: 476.4316

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)OC2=CC3=C(C=C2)C=C(C(=O)O3)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)OC2=CC3=C(C=C2)C=C(C(=O)O3)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C26H20O9/c1-29-22-10-16(11-23(30-2)24(22)31-3)25(27)34-17-6-4-15-8-18(26(28)35-20(15)12-17)14-5-7-19-21(9-14)33-13-32-19/h4-12H,13H2,1-3H3