N7-ethyl-N5-(4-iodophenyl)-4-nitro-2,1,3-benzoxadiazole-5,7-diamine

Systemtic Name: N7-ethyl-N5-(4-iodophenyl)-4-nitro-2,1,3-benzoxadiazole-5,7-diamine Openeye Name: N7-ethyl-N5-(4-iodophenyl)-4-nitro-2,1,3-benzoxadiazole-5,7-diamine CAS Name: N7-ethyl-N5-(4-iodophenyl)-4-nitro-2,1,3-benzoxadiazole-5,7-diamine IUPAC Name: 7-N-ethyl-5-N-(4-iodophenyl)-4-nitro-2,1,3-benzoxadiazole-5,7-diamine Traditional Name: ethyl-[6-(4-iodoanilino)-7-nitro-benzofurazan-4-yl]amine Formula: C14H12IN5O3 MolecularWeight: 425.18125

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=CC(=C(C2=NON=C12)[N+](=O)[O-])NC3=CC=C(C=C3)I

Isomeric SMILES

CCNC1=CC(=C(C2=NON=C12)[N+](=O)[O-])NC3=CC=C(C=C3)I

InChI

InChI=1S/C14H12IN5O3/c1-2-16-10-7-11(17-9-5-3-8(15)4-6-9)14(20(21)22)13-12(10)18-23-19-13/h3-7,16-17H,2H2,1H3