N-(5-methoxy-2-methyl-4-nitro-phenyl)-5-(4-methylpiperidin-1-yl)-4-nitro-2,1,3-benzoxadiazol-7-amine

Systemtic Name: N-(5-methoxy-2-methyl-4-nitro-phenyl)-5-(4-methylpiperidin-1-yl)-4-nitro-2,1,3-benzoxadiazol-7-amine Openeye Name: N-(5-methoxy-2-methyl-4-nitro-phenyl)-5-(4-methyl-1-piperidyl)-4-nitro-2,1,3-benzoxadiazol-7-amine CAS Name: N-(5-methoxy-2-methyl-4-nitrophenyl)-5-(4-methyl-1-piperidinyl)-4-nitro-2,1,3-benzoxadiazol-7-amine IUPAC Name: N-(5-methoxy-2-methyl-4-nitrophenyl)-5-(4-methylpiperidin-1-yl)-4-nitro-2,1,3-benzoxadiazol-7-amine Traditional Name: (5-methoxy-2-methyl-4-nitro-phenyl)-[6-(4-methylpiperidino)-7-nitro-benzofurazan-4-yl]amine Formula: C20H22N6O6 MolecularWeight: 442.42528

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C3=NON=C3C(=C2)NC4=CC(=C(C=C4C)[N+](=O)[O-])OC)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)C2=C(C3=NON=C3C(=C2)NC4=CC(=C(C=C4C)[N+](=O)[O-])OC)[N+](=O)[O-]

InChI

InChI=1S/C20H22N6O6/c1-11-4-6-24(7-5-11)16-9-14(18-19(23-32-22-18)20(16)26(29)30)21-13-10-17(31-3)15(25(27)28)8-12(13)2/h8-11,21H,4-7H2,1-3H3