methyl 2-[(4-oxidanylidene-6,7-dihydro-5H-1-benzofuran-3-yl)carbonyl]-3,4-dihydro-1H-isoquinoline-7-carboxylate

Systemtic Name: methyl 2-[(4-oxidanylidene-6,7-dihydro-5H-1-benzofuran-3-yl)carbonyl]-3,4-dihydro-1H-isoquinoline-7-carboxylate Openeye Name: methyl 2-(4-oxo-6,7-dihydro-5H-benzofuran-3-carbonyl)-3,4-dihydro-1H-isoquinoline-7-carboxylate CAS Name: 2-[oxo-(4-oxo-6,7-dihydro-5H-benzofuran-3-yl)methyl]-3,4-dihydro-1H-isoquinoline-7-carboxylic acid methyl ester IUPAC Name: methyl 2-(4-oxo-6,7-dihydro-5H-1-benzofuran-3-carbonyl)-3,4-dihydro-1H-isoquinoline-7-carboxylate Traditional Name: 2-(4-keto-6,7-dihydro-5H-benzofuran-3-carbonyl)-3,4-dihydro-1H-isoquinoline-7-carboxylic acid methyl ester Formula: C20H19NO5 MolecularWeight: 353.36856

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(CCN(C2)C(=O)C3=COC4=C3C(=O)CCC4)C=C1

Isomeric SMILES

COC(=O)C1=CC2=C(CCN(C2)C(=O)C3=COC4=C3C(=O)CCC4)C=C1

InChI

InChI=1S/C20H19NO5/c1-25-20(24)13-6-5-12-7-8-21(10-14(12)9-13)19(23)15-11-26-17-4-2-3-16(22)18(15)17/h5-6,9,11H,2-4,7-8,10H2,1H3