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

Systemtic Name: 5-(4-methylpiperazin-1-yl)-4-nitro-N-(phenylmethyl)-2,1,3-benzoxadiazol-7-amine Openeye Name: N-benzyl-5-(4-methylpiperazin-1-yl)-4-nitro-2,1,3-benzoxadiazol-7-amine CAS Name: 5-(4-methyl-1-piperazinyl)-4-nitro-N-(phenylmethyl)-2,1,3-benzoxadiazol-7-amine IUPAC Name: N-benzyl-5-(4-methylpiperazin-1-yl)-4-nitro-2,1,3-benzoxadiazol-7-amine Traditional Name: benzyl-[6-(4-methylpiperazino)-7-nitro-benzofurazan-4-yl]amine Formula: C18H20N6O3 MolecularWeight: 368.3898

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C3=NON=C3C(=C2)NCC4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CN1CCN(CC1)C2=C(C3=NON=C3C(=C2)NCC4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C18H20N6O3/c1-22-7-9-23(10-8-22)15-11-14(19-12-13-5-3-2-4-6-13)16-17(21-27-20-16)18(15)24(25)26/h2-6,11,19H,7-10,12H2,1H3