4-[[(3-ethyl-4-oxidanylidene-phthalazin-1-yl)carbonylamino]methyl]benzoate

Systemtic Name: 4-[[(3-ethyl-4-oxidanylidene-phthalazin-1-yl)carbonylamino]methyl]benzoate Openeye Name: 4-[[(3-ethyl-4-oxo-phthalazine-1-carbonyl)amino]methyl]benzoate CAS Name: 4-[[[(3-ethyl-4-oxo-1-phthalazinyl)-oxomethyl]amino]methyl]benzoate IUPAC Name: 4-[[(3-ethyl-4-oxophthalazine-1-carbonyl)amino]methyl]benzoate Traditional Name: 4-[[(3-ethyl-4-keto-phthalazine-1-carbonyl)amino]methyl]benzoate Formula: C19H16N3O4- MolecularWeight: 350.34804

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCC3=CC=C(C=C3)C(=O)[O-]

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCC3=CC=C(C=C3)C(=O)[O-]

InChI

InChI=1S/C19H17N3O4/c1-2-22-18(24)15-6-4-3-5-14(15)16(21-22)17(23)20-11-12-7-9-13(10-8-12)19(25)26/h3-10H,2,11H2,1H3,(H,20,23)(H,25,26)/p-1