methyl 5-[[2-(2-ethoxyethyl)-1-oxidanylidene-isoquinolin-5-yl]oxymethyl]furan-2-carboxylate

Systemtic Name: methyl 5-[[2-(2-ethoxyethyl)-1-oxidanylidene-isoquinolin-5-yl]oxymethyl]furan-2-carboxylate Openeye Name: methyl 5-[[2-(2-ethoxyethyl)-1-oxo-5-isoquinolyl]oxymethyl]furan-2-carboxylate CAS Name: 5-[[2-(2-ethoxyethyl)-1-oxo-5-isoquinolinyl]oxymethyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[[2-(2-ethoxyethyl)-1-oxoisoquinolin-5-yl]oxymethyl]furan-2-carboxylate Traditional Name: 5-[[2-(2-ethoxyethyl)-1-keto-5-isoquinolyl]oxymethyl]furan-2-carboxylic acid methyl ester Formula: C20H21NO6 MolecularWeight: 371.38384

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCN1C=CC2=C(C1=O)C=CC=C2OCC3=CC=C(O3)C(=O)OC

Isomeric SMILES

CCOCCN1C=CC2=C(C1=O)C=CC=C2OCC3=CC=C(O3)C(=O)OC

InChI

InChI=1S/C20H21NO6/c1-3-25-12-11-21-10-9-15-16(19(21)22)5-4-6-17(15)26-13-14-7-8-18(27-14)20(23)24-2/h4-10H,3,11-13H2,1-2H3