5-nitro-3-[[4-[(2R)-oxolan-2-yl]carbonylpiperazin-1-ium-1-yl]methyl]-1,3-benzoxazol-2-one

Systemtic Name: 5-nitro-3-[[4-[(2R)-oxolan-2-yl]carbonylpiperazin-1-ium-1-yl]methyl]-1,3-benzoxazol-2-one Openeye Name: 5-nitro-3-[[4-[(2R)-tetrahydrofuran-2-carbonyl]piperazin-1-ium-1-yl]methyl]-1,3-benzoxazol-2-one CAS Name: 5-nitro-3-[[4-[oxo-[(2R)-2-oxolanyl]methyl]-1-piperazin-1-iumyl]methyl]-1,3-benzoxazol-2-one IUPAC Name: 5-nitro-3-[[4-[(2R)-oxolane-2-carbonyl]piperazin-1-ium-1-yl]methyl]-1,3-benzoxazol-2-one Traditional Name: 5-nitro-3-[[4-[(2R)-tetrahydrofuran-2-carbonyl]piperazin-1-ium-1-yl]methyl]-1,3-benzoxazol-2-one Formula: C17H21N4O6+ MolecularWeight: 377.37184

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)C(=O)N2CC[NH+](CC2)CN3C4=C(C=CC(=C4)[N+](=O)[O-])OC3=O

Isomeric SMILES

C1C[C@@H](OC1)C(=O)N2CC[NH+](CC2)CN3C4=C(C=CC(=C4)[N+](=O)[O-])OC3=O

InChI

InChI=1S/C17H20N4O6/c22-16(15-2-1-9-26-15)19-7-5-18(6-8-19)11-20-13-10-12(21(24)25)3-4-14(13)27-17(20)23/h3-4,10,15H,1-2,5-9,11H2/p+1/t15-/m1/s1