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

Systemtic Name: 2-[[7-[(5-methoxy-2-methyl-4-nitro-phenyl)amino]-4-nitro-2,1,3-benzoxadiazol-5-yl]amino]ethanol Openeye Name: 2-[[7-(5-methoxy-2-methyl-4-nitro-anilino)-4-nitro-2,1,3-benzoxadiazol-5-yl]amino]ethanol CAS Name: 2-[[7-(5-methoxy-2-methyl-4-nitroanilino)-4-nitro-2,1,3-benzoxadiazol-5-yl]amino]ethanol IUPAC Name: 2-[[7-(5-methoxy-2-methyl-4-nitroanilino)-4-nitro-2,1,3-benzoxadiazol-5-yl]amino]ethanol Traditional Name: 2-[[7-(5-methoxy-2-methyl-4-nitro-anilino)-4-nitro-benzofurazan-5-yl]amino]ethanol Formula: C16H16N6O7 MolecularWeight: 404.33424

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16N6O7/c1-8-5-12(21(24)25)13(28-2)7-9(8)18-10-6-11(17-3-4-23)16(22(26)27)15-14(10)19-29-20-15/h5-7,17-18,23H,3-4H2,1-2H3