N5,N5-dimethyl-4-nitro-N7-phenyl-N7-(1-pyridin-3-ylethyl)-2,1,3-benzoxadiazole-5,7-diamine

Systemtic Name: N5,N5-dimethyl-4-nitro-N7-phenyl-N7-(1-pyridin-3-ylethyl)-2,1,3-benzoxadiazole-5,7-diamine Openeye Name: N5,N5-dimethyl-4-nitro-N7-phenyl-N7-[1-(3-pyridyl)ethyl]-2,1,3-benzoxadiazole-5,7-diamine CAS Name: N5,N5-dimethyl-4-nitro-N7-phenyl-N7-[1-(3-pyridinyl)ethyl]-2,1,3-benzoxadiazole-5,7-diamine IUPAC Name: 5-N,5-N-dimethyl-4-nitro-7-N-phenyl-7-N-(1-pyridin-3-ylethyl)-2,1,3-benzoxadiazole-5,7-diamine Traditional Name: dimethyl-[4-nitro-7-[N-[1-(3-pyridyl)ethyl]anilino]benzofurazan-5-yl]amine Formula: C21H20N6O3 MolecularWeight: 404.4219

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CN=CC=C1)N(C2=CC=CC=C2)C3=CC(=C(C4=NON=C34)[N+](=O)[O-])N(C)C

Isomeric SMILES

CC(C1=CN=CC=C1)N(C2=CC=CC=C2)C3=CC(=C(C4=NON=C34)[N+](=O)[O-])N(C)C

InChI

InChI=1S/C21H20N6O3/c1-14(15-8-7-11-22-13-15)26(16-9-5-4-6-10-16)17-12-18(25(2)3)21(27(28)29)20-19(17)23-30-24-20/h4-14H,1-3H3