4-nitro-N7-(3-nitrophenyl)-N5-(phenylmethyl)-2,1,3-benzoxadiazole-5,7-diamine

Systemtic Name: 4-nitro-N7-(3-nitrophenyl)-N5-(phenylmethyl)-2,1,3-benzoxadiazole-5,7-diamine Openeye Name: N5-benzyl-4-nitro-N7-(3-nitrophenyl)-2,1,3-benzoxadiazole-5,7-diamine CAS Name: 4-nitro-N7-(3-nitrophenyl)-N5-(phenylmethyl)-2,1,3-benzoxadiazole-5,7-diamine IUPAC Name: 5-N-benzyl-4-nitro-7-N-(3-nitrophenyl)-2,1,3-benzoxadiazole-5,7-diamine Traditional Name: benzyl-[4-nitro-7-(3-nitroanilino)benzofurazan-5-yl]amine Formula: C19H14N6O5 MolecularWeight: 406.35166

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=C(C3=NON=C3C(=C2)NC4=CC(=CC=C4)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CNC2=C(C3=NON=C3C(=C2)NC4=CC(=CC=C4)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C19H14N6O5/c26-24(27)14-8-4-7-13(9-14)21-15-10-16(20-11-12-5-2-1-3-6-12)19(25(28)29)18-17(15)22-30-23-18/h1-10,20-21H,11H2