N-[6-nitro-1-(4-nitrophenyl)-5-phenyl-1,3-diazepin-2-yl]pyridine-2-carboxamide

Systemtic Name: N-[6-nitro-1-(4-nitrophenyl)-5-phenyl-1,3-diazepin-2-yl]pyridine-2-carboxamide Openeye Name: N-[6-nitro-1-(4-nitrophenyl)-5-phenyl-1,3-diazepin-2-yl]pyridine-2-carboxamide CAS Name: N-[6-nitro-1-(4-nitrophenyl)-5-phenyl-1,3-diazepin-2-yl]-2-pyridinecarboxamide IUPAC Name: N-[6-nitro-1-(4-nitrophenyl)-5-phenyl-1,3-diazepin-2-yl]pyridine-2-carboxamide Traditional Name: N-[6-nitro-1-(4-nitrophenyl)-5-phenyl-1,3-diazepin-2-yl]picolinamide Formula: C23H16N6O5 MolecularWeight: 456.41034

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CN=C(N(C=C2[N+](=O)[O-])C3=CC=C(C=C3)[N+](=O)[O-])NC(=O)C4=CC=CC=N4

Isomeric SMILES

C1=CC=C(C=C1)C2=CN=C(N(C=C2[N+](=O)[O-])C3=CC=C(C=C3)[N+](=O)[O-])NC(=O)C4=CC=CC=N4

InChI

InChI=1S/C23H16N6O5/c30-22(20-8-4-5-13-24-20)26-23-25-14-19(16-6-2-1-3-7-16)21(29(33)34)15-27(23)17-9-11-18(12-10-17)28(31)32/h1-15H,(H,25,26,30)