1,3-benzodioxol-5-yl 1-oxidanylidene-3,4-dihydroisochromene-3-carboxylate

Systemtic Name: 1,3-benzodioxol-5-yl 1-oxidanylidene-3,4-dihydroisochromene-3-carboxylate Openeye Name: 1,3-benzodioxol-5-yl 1-oxoisochromane-3-carboxylate CAS Name: 1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxylic acid 1,3-benzodioxol-5-yl ester IUPAC Name: 1,3-benzodioxol-5-yl 1-oxo-3,4-dihydroisochromene-3-carboxylate Traditional Name: 1-ketoisochroman-3-carboxylic acid 1,3-benzodioxol-5-yl ester Formula: C17H12O6 MolecularWeight: 312.27358

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC(=O)C2=CC=CC=C21)C(=O)OC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1C(OC(=O)C2=CC=CC=C21)C(=O)OC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C17H12O6/c18-16-12-4-2-1-3-10(12)7-15(23-16)17(19)22-11-5-6-13-14(8-11)21-9-20-13/h1-6,8,15H,7,9H2