3-(2-methylpropyl)-N-(3-nitrophenyl)-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-(2-methylpropyl)-N-(3-nitrophenyl)-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-isobutyl-N-(3-nitrophenyl)-4-oxo-phthalazine-1-carboxamide CAS Name: 3-(2-methylpropyl)-N-(3-nitrophenyl)-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-(2-methylpropyl)-N-(3-nitrophenyl)-4-oxophthalazine-1-carboxamide Traditional Name: 3-isobutyl-4-keto-N-(3-nitrophenyl)phthalazine-1-carboxamide Formula: C19H18N4O4 MolecularWeight: 366.37062

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC(=CC=C3)[N+](=O)[O-]

InChI

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