N-(4-chlorophenyl)-N-(furan-2-ylmethyl)-5-(4-methylpiperazin-1-yl)-4-nitro-2,1,3-benzoxadiazol-7-amine

Systemtic Name: N-(4-chlorophenyl)-N-(furan-2-ylmethyl)-5-(4-methylpiperazin-1-yl)-4-nitro-2,1,3-benzoxadiazol-7-amine Openeye Name: N-(4-chlorophenyl)-N-(2-furylmethyl)-5-(4-methylpiperazin-1-yl)-4-nitro-2,1,3-benzoxadiazol-7-amine CAS Name: N-(4-chlorophenyl)-N-(2-furanylmethyl)-5-(4-methyl-1-piperazinyl)-4-nitro-2,1,3-benzoxadiazol-7-amine IUPAC Name: N-(4-chlorophenyl)-N-(furan-2-ylmethyl)-5-(4-methylpiperazin-1-yl)-4-nitro-2,1,3-benzoxadiazol-7-amine Traditional Name: (4-chlorophenyl)-(2-furfuryl)-[6-(4-methylpiperazino)-7-nitro-benzofurazan-4-yl]amine Formula: C22H21ClN6O4 MolecularWeight: 468.89294

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C3=NON=C3C(=C2)N(CC4=CC=CO4)C5=CC=C(C=C5)Cl)[N+](=O)[O-]

Isomeric SMILES

CN1CCN(CC1)C2=C(C3=NON=C3C(=C2)N(CC4=CC=CO4)C5=CC=C(C=C5)Cl)[N+](=O)[O-]

InChI

InChI=1S/C22H21ClN6O4/c1-26-8-10-27(11-9-26)19-13-18(20-21(25-33-24-20)22(19)29(30)31)28(14-17-3-2-12-32-17)16-6-4-15(23)5-7-16/h2-7,12-13H,8-11,14H2,1H3