ethyl N-[3-[4-(2-nitrooxyethyl)piperazin-1-yl]-1,2,3-oxadiazol-3-ium-5-yl]carbamate

Systemtic Name: ethyl N-[3-[4-(2-nitrooxyethyl)piperazin-1-yl]-1,2,3-oxadiazol-3-ium-5-yl]carbamate Openeye Name: ethyl N-[3-[4-(2-nitrooxyethyl)piperazin-1-yl]oxadiazol-3-ium-5-yl]carbamate CAS Name: N-[3-[4-(2-nitrooxyethyl)-1-piperazinyl]-5-oxadiazol-3-iumyl]carbamic acid ethyl ester IUPAC Name: ethyl N-[3-[4-(2-nitrooxyethyl)piperazin-1-yl]oxadiazol-3-ium-5-yl]carbamate Traditional Name: N-[3-[4-(2-nitrooxyethyl)piperazino]oxadiazol-3-ium-5-yl]carbamic acid ethyl ester Formula: C11H19N6O6+ MolecularWeight: 331.30516

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC1=C[N+](=NO1)N2CCN(CC2)CCO[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)NC1=C[N+](=NO1)N2CCN(CC2)CCO[N+](=O)[O-]

InChI

InChI=1S/C11H18N6O6/c1-2-21-11(18)12-10-9-16(13-23-10)15-5-3-14(4-6-15)7-8-22-17(19)20/h9H,2-8H2,1H3/p+1