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

Systemtic Name: methyl 4-[3-[1,3-bis(oxidanylidene)-4H-isoquinolin-2-yl]propanoylamino]benzoate Openeye Name: methyl 4-[3-(1,3-dioxo-4H-isoquinolin-2-yl)propanoylamino]benzoate CAS Name: 4-[[3-(1,3-dioxo-4H-isoquinolin-2-yl)-1-oxopropyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[3-(1,3-dioxo-4H-isoquinolin-2-yl)propanoylamino]benzoate Traditional Name: 4-[3-(1,3-diketo-4H-isoquinolin-2-yl)propanoylamino]benzoic acid methyl ester Formula: C20H18N2O5 MolecularWeight: 366.36732

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H18N2O5/c1-27-20(26)13-6-8-15(9-7-13)21-17(23)10-11-22-18(24)12-14-4-2-3-5-16(14)19(22)25/h2-9H,10-12H2,1H3,(H,21,23)