2-[[7-[(5-methoxy-2-methyl-4-nitro-phenyl)amino]-4-nitro-2,1,3-benzoxadiazol-5-yl]-methyl-amino]ethanol

Systemtic Name: 2-[[7-[(5-methoxy-2-methyl-4-nitro-phenyl)amino]-4-nitro-2,1,3-benzoxadiazol-5-yl]-methyl-amino]ethanol Openeye Name: 2-[[7-(5-methoxy-2-methyl-4-nitro-anilino)-4-nitro-2,1,3-benzoxadiazol-5-yl]-methyl-amino]ethanol CAS Name: 2-[[7-(5-methoxy-2-methyl-4-nitroanilino)-4-nitro-2,1,3-benzoxadiazol-5-yl]-methylamino]ethanol IUPAC Name: 2-[[7-(5-methoxy-2-methyl-4-nitroanilino)-4-nitro-2,1,3-benzoxadiazol-5-yl]-methylamino]ethanol Traditional Name: 2-[[7-(5-methoxy-2-methyl-4-nitro-anilino)-4-nitro-benzofurazan-5-yl]-methyl-amino]ethanol Formula: C17H18N6O7 MolecularWeight: 418.36082

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1NC2=CC(=C(C3=NON=C23)[N+](=O)[O-])N(C)CCO)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1NC2=CC(=C(C3=NON=C23)[N+](=O)[O-])N(C)CCO)OC)[N+](=O)[O-]

InChI

InChI=1S/C17H18N6O7/c1-9-6-12(22(25)26)14(29-3)8-10(9)18-11-7-13(21(2)4-5-24)17(23(27)28)16-15(11)19-30-20-16/h6-8,18,24H,4-5H2,1-3H3