N-[(Z)-(3-nitrophenyl)methylideneamino]-4-oxidanylidene-3H-phthalazine-1-carboxamide

Systemtic Name: N-[(Z)-(3-nitrophenyl)methylideneamino]-4-oxidanylidene-3H-phthalazine-1-carboxamide Openeye Name: N-[(Z)-(3-nitrophenyl)methyleneamino]-4-oxo-3H-phthalazine-1-carboxamide CAS Name: N-[(Z)-(3-nitrophenyl)methylideneamino]-4-oxo-3H-phthalazine-1-carboxamide IUPAC Name: N-[(Z)-(3-nitrophenyl)methylideneamino]-4-oxo-3H-phthalazine-1-carboxamide Traditional Name: 4-keto-N-[(Z)-(3-nitrobenzylidene)amino]-3H-phthalazine-1-carboxamide Formula: C16H11N5O4 MolecularWeight: 337.28964

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NNC2=O)C(=O)NN=CC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=NNC2=O)C(=O)N/N=C\C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H11N5O4/c22-15-13-7-2-1-6-12(13)14(18-20-15)16(23)19-17-9-10-4-3-5-11(8-10)21(24)25/h1-9H,(H,19,23)(H,20,22)/b17-9-