methyl 4-[[2-[2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanoyloxy]ethanoylamino]methyl]benzoate

Systemtic Name: methyl 4-[[2-[2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanoyloxy]ethanoylamino]methyl]benzoate Openeye Name: methyl 4-[[[2-[2-(4-oxo-3H-phthalazin-1-yl)acetyl]oxyacetyl]amino]methyl]benzoate CAS Name: 4-[[[1-oxo-2-[1-oxo-2-(4-oxo-3H-phthalazin-1-yl)ethoxy]ethyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[2-[2-(4-oxo-3H-phthalazin-1-yl)acetyl]oxyacetyl]amino]methyl]benzoate Traditional Name: 4-[[[2-[2-(4-keto-3H-phthalazin-1-yl)acetyl]oxyacetyl]amino]methyl]benzoic acid methyl ester Formula: C21H19N3O6 MolecularWeight: 409.39206

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CNC(=O)COC(=O)CC2=NNC(=O)C3=CC=CC=C32

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CNC(=O)COC(=O)CC2=NNC(=O)C3=CC=CC=C32

InChI

InChI=1S/C21H19N3O6/c1-29-21(28)14-8-6-13(7-9-14)11-22-18(25)12-30-19(26)10-17-15-4-2-3-5-16(15)20(27)24-23-17/h2-9H,10-12H2,1H3,(H,22,25)(H,24,27)