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

Systemtic Name: N-(4-methoxy-2-nitro-phenyl)-5-(4-methylpiperidin-1-yl)-4-nitro-2,1,3-benzoxadiazol-7-amine Openeye Name: N-(4-methoxy-2-nitro-phenyl)-5-(4-methyl-1-piperidyl)-4-nitro-2,1,3-benzoxadiazol-7-amine CAS Name: N-(4-methoxy-2-nitrophenyl)-5-(4-methyl-1-piperidinyl)-4-nitro-2,1,3-benzoxadiazol-7-amine IUPAC Name: N-(4-methoxy-2-nitrophenyl)-5-(4-methylpiperidin-1-yl)-4-nitro-2,1,3-benzoxadiazol-7-amine Traditional Name: (4-methoxy-2-nitro-phenyl)-[6-(4-methylpiperidino)-7-nitro-benzofurazan-4-yl]amine Formula: C19H20N6O6 MolecularWeight: 428.3987

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C3=NON=C3C(=C2)NC4=C(C=C(C=C4)OC)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)C2=C(C3=NON=C3C(=C2)NC4=C(C=C(C=C4)OC)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C19H20N6O6/c1-11-5-7-23(8-6-11)16-10-14(17-18(22-31-21-17)19(16)25(28)29)20-13-4-3-12(30-2)9-15(13)24(26)27/h3-4,9-11,20H,5-8H2,1-2H3