N-(2,4-dimethyl-5-nitro-phenyl)-4-oxidanylidene-3-phenyl-phthalazine-1-carboxamide

Systemtic Name: N-(2,4-dimethyl-5-nitro-phenyl)-4-oxidanylidene-3-phenyl-phthalazine-1-carboxamide Openeye Name: N-(2,4-dimethyl-5-nitro-phenyl)-4-oxo-3-phenyl-phthalazine-1-carboxamide CAS Name: N-(2,4-dimethyl-5-nitrophenyl)-4-oxo-3-phenyl-1-phthalazinecarboxamide IUPAC Name: N-(2,4-dimethyl-5-nitrophenyl)-4-oxo-3-phenylphthalazine-1-carboxamide Traditional Name: N-(2,4-dimethyl-5-nitro-phenyl)-4-keto-3-phenyl-phthalazine-1-carboxamide Formula: C23H18N4O4 MolecularWeight: 414.41342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1NC(=O)C2=NN(C(=O)C3=CC=CC=C32)C4=CC=CC=C4)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C=C1NC(=O)C2=NN(C(=O)C3=CC=CC=C32)C4=CC=CC=C4)[N+](=O)[O-])C

InChI

InChI=1S/C23H18N4O4/c1-14-12-15(2)20(27(30)31)13-19(14)24-22(28)21-17-10-6-7-11-18(17)23(29)26(25-21)16-8-4-3-5-9-16/h3-13H,1-2H3,(H,24,28)