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

Systemtic Name: propan-2-yl 4-[2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanoylamino]benzoate Openeye Name: isopropyl 4-[[2-(4-oxo-3H-phthalazin-1-yl)acetyl]amino]benzoate CAS Name: 4-[[1-oxo-2-(4-oxo-3H-phthalazin-1-yl)ethyl]amino]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[[2-(4-oxo-3H-phthalazin-1-yl)acetyl]amino]benzoate Traditional Name: 4-[[2-(4-keto-3H-phthalazin-1-yl)acetyl]amino]benzoic acid isopropyl ester Formula: C20H19N3O4 MolecularWeight: 365.38256

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=CC=C(C=C1)NC(=O)CC2=NNC(=O)C3=CC=CC=C32

Isomeric SMILES

CC(C)OC(=O)C1=CC=C(C=C1)NC(=O)CC2=NNC(=O)C3=CC=CC=C32

InChI

InChI=1S/C20H19N3O4/c1-12(2)27-20(26)13-7-9-14(10-8-13)21-18(24)11-17-15-5-3-4-6-16(15)19(25)23-22-17/h3-10,12H,11H2,1-2H3,(H,21,24)(H,23,25)