[2-oxidanylidene-2-(1H-pyrrol-2-yl)ethyl] 2,3-dihydro-1,4-benzodioxine-6-carboxylate

Systemtic Name: [2-oxidanylidene-2-(1H-pyrrol-2-yl)ethyl] 2,3-dihydro-1,4-benzodioxine-6-carboxylate Openeye Name: [2-oxo-2-(1H-pyrrol-2-yl)ethyl] 2,3-dihydro-1,4-benzodioxine-6-carboxylate CAS Name: 2,3-dihydro-1,4-benzodioxin-6-carboxylic acid [2-oxo-2-(1H-pyrrol-2-yl)ethyl] ester IUPAC Name: [2-oxo-2-(1H-pyrrol-2-yl)ethyl] 2,3-dihydro-1,4-benzodioxine-6-carboxylate Traditional Name: 2,3-dihydro-1,4-benzodioxin-6-carboxylic acid [2-keto-2-(1H-pyrrol-2-yl)ethyl] ester Formula: C15H13NO5 MolecularWeight: 287.26742

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)C(=O)OCC(=O)C3=CC=CN3

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)C(=O)OCC(=O)C3=CC=CN3

InChI

InChI=1S/C15H13NO5/c17-12(11-2-1-5-16-11)9-21-15(18)10-3-4-13-14(8-10)20-7-6-19-13/h1-5,8,16H,6-7,9H2