7-(4-ethylpiperazin-1-yl)-4-nitro-5-pyrrolidin-1-yl-2,1,3-benzoxadiazole

Systemtic Name: 7-(4-ethylpiperazin-1-yl)-4-nitro-5-pyrrolidin-1-yl-2,1,3-benzoxadiazole Openeye Name: 7-(4-ethylpiperazin-1-yl)-4-nitro-5-pyrrolidin-1-yl-2,1,3-benzoxadiazole CAS Name: 7-(4-ethyl-1-piperazinyl)-4-nitro-5-(1-pyrrolidinyl)-2,1,3-benzoxadiazole IUPAC Name: 7-(4-ethylpiperazin-1-yl)-4-nitro-5-pyrrolidin-1-yl-2,1,3-benzoxadiazole Traditional Name: 7-(4-ethylpiperazino)-4-nitro-5-pyrrolidino-benzofurazan Formula: C16H22N6O3 MolecularWeight: 346.38428

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=CC(=C(C3=NON=C23)[N+](=O)[O-])N4CCCC4

Isomeric SMILES

CCN1CCN(CC1)C2=CC(=C(C3=NON=C23)[N+](=O)[O-])N4CCCC4

InChI

InChI=1S/C16H22N6O3/c1-2-19-7-9-21(10-8-19)12-11-13(20-5-3-4-6-20)16(22(23)24)15-14(12)17-25-18-15/h11H,2-10H2,1H3