methyl 4-[3-[1,3-bis(oxidanylidene)-4H-isoquinolin-2-yl]propanoyloxymethyl]benzoate

Systemtic Name: methyl 4-[3-[1,3-bis(oxidanylidene)-4H-isoquinolin-2-yl]propanoyloxymethyl]benzoate Openeye Name: methyl 4-[3-(1,3-dioxo-4H-isoquinolin-2-yl)propanoyloxymethyl]benzoate CAS Name: 4-[[3-(1,3-dioxo-4H-isoquinolin-2-yl)-1-oxopropoxy]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[3-(1,3-dioxo-4H-isoquinolin-2-yl)propanoyloxymethyl]benzoate Traditional Name: 4-[3-(1,3-diketo-4H-isoquinolin-2-yl)propanoyloxymethyl]benzoic acid methyl ester Formula: C21H19NO6 MolecularWeight: 381.37866

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)COC(=O)CCN2C(=O)CC3=CC=CC=C3C2=O

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)COC(=O)CCN2C(=O)CC3=CC=CC=C3C2=O

InChI

InChI=1S/C21H19NO6/c1-27-21(26)15-8-6-14(7-9-15)13-28-19(24)10-11-22-18(23)12-16-4-2-3-5-17(16)20(22)25/h2-9H,10-13H2,1H3