(3-nitrophenyl) 3-ethyl-4-oxidanylidene-phthalazine-1-carboxylate

Systemtic Name: (3-nitrophenyl) 3-ethyl-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: (3-nitrophenyl) 3-ethyl-4-oxo-phthalazine-1-carboxylate CAS Name: 3-ethyl-4-oxo-1-phthalazinecarboxylic acid (3-nitrophenyl) ester IUPAC Name: (3-nitrophenyl) 3-ethyl-4-oxophthalazine-1-carboxylate Traditional Name: 3-ethyl-4-keto-phthalazine-1-carboxylic acid (3-nitrophenyl) ester Formula: C17H13N3O5 MolecularWeight: 339.30222

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OC3=CC=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OC3=CC=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H13N3O5/c1-2-19-16(21)14-9-4-3-8-13(14)15(18-19)17(22)25-12-7-5-6-11(10-12)20(23)24/h3-10H,2H2,1H3