ethyl 4-[(4-oxidanylidene-3H-phthalazin-1-yl)methylcarbamoylamino]benzoate

Systemtic Name: ethyl 4-[(4-oxidanylidene-3H-phthalazin-1-yl)methylcarbamoylamino]benzoate Openeye Name: ethyl 4-[(4-oxo-3H-phthalazin-1-yl)methylcarbamoylamino]benzoate CAS Name: 4-[[oxo-[(4-oxo-3H-phthalazin-1-yl)methylamino]methyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(4-oxo-3H-phthalazin-1-yl)methylcarbamoylamino]benzoate Traditional Name: 4-[(4-keto-3H-phthalazin-1-yl)methylcarbamoylamino]benzoic acid ethyl ester Formula: C19H18N4O4 MolecularWeight: 366.37062

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)NCC2=NNC(=O)C3=CC=CC=C32

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)NCC2=NNC(=O)C3=CC=CC=C32

InChI

InChI=1S/C19H18N4O4/c1-2-27-18(25)12-7-9-13(10-8-12)21-19(26)20-11-16-14-5-3-4-6-15(14)17(24)23-22-16/h3-10H,2,11H2,1H3,(H,23,24)(H2,20,21,26)