methyl 4-(4,5-dimethoxy-3-oxidanylidene-1H-isoindol-2-yl)benzoate

Systemtic Name: methyl 4-(4,5-dimethoxy-3-oxidanylidene-1H-isoindol-2-yl)benzoate Openeye Name: methyl 4-(6,7-dimethoxy-1-oxo-isoindolin-2-yl)benzoate CAS Name: 4-(4,5-dimethoxy-3-oxo-1H-isoindol-2-yl)benzoic acid methyl ester IUPAC Name: methyl 4-(4,5-dimethoxy-3-oxo-1H-isoindol-2-yl)benzoate Traditional Name: 4-(1-keto-6,7-dimethoxy-isoindolin-2-yl)benzoic acid methyl ester Formula: C18H17NO5 MolecularWeight: 327.33128

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(CN(C2=O)C3=CC=C(C=C3)C(=O)OC)C=C1)OC

Isomeric SMILES

COC1=C(C2=C(CN(C2=O)C3=CC=C(C=C3)C(=O)OC)C=C1)OC

InChI

InChI=1S/C18H17NO5/c1-22-14-9-6-12-10-19(17(20)15(12)16(14)23-2)13-7-4-11(5-8-13)18(21)24-3/h4-9H,10H2,1-3H3