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

Systemtic Name: 5-(4-methylpiperidin-1-yl)-4-nitro-N-(3-nitrophenyl)-2,1,3-benzoxadiazol-7-amine Openeye Name: 5-(4-methyl-1-piperidyl)-4-nitro-N-(3-nitrophenyl)-2,1,3-benzoxadiazol-7-amine CAS Name: 5-(4-methyl-1-piperidinyl)-4-nitro-N-(3-nitrophenyl)-2,1,3-benzoxadiazol-7-amine IUPAC Name: 5-(4-methylpiperidin-1-yl)-4-nitro-N-(3-nitrophenyl)-2,1,3-benzoxadiazol-7-amine Traditional Name: [6-(4-methylpiperidino)-7-nitro-benzofurazan-4-yl]-(3-nitrophenyl)amine Formula: C18H18N6O5 MolecularWeight: 398.37272

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18N6O5/c1-11-5-7-22(8-6-11)15-10-14(16-17(21-29-20-16)18(15)24(27)28)19-12-3-2-4-13(9-12)23(25)26/h2-4,9-11,19H,5-8H2,1H3