4-[(1R)-2-azaniumyl-1-morpholin-4-yl-ethyl]-2-nitro-phenolate

Systemtic Name: 4-[(1R)-2-azaniumyl-1-morpholin-4-yl-ethyl]-2-nitro-phenolate Openeye Name: 4-[(1R)-2-azaniumyl-1-morpholino-ethyl]-2-nitro-phenolate CAS Name: 4-[(1R)-2-ammonio-1-(4-morpholinyl)ethyl]-2-nitrophenolate IUPAC Name: 4-[(1R)-2-azaniumyl-1-morpholin-4-ylethyl]-2-nitrophenolate Traditional Name: 4-[(1R)-2-ammonio-1-morpholino-ethyl]-2-nitro-phenolate Formula: C12H17N3O4 MolecularWeight: 267.28108

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(C[NH3+])C2=CC(=C(C=C2)[O-])[N+](=O)[O-]

Isomeric SMILES

C1COCCN1[C@@H](C[NH3+])C2=CC(=C(C=C2)[O-])[N+](=O)[O-]

InChI

InChI=1S/C12H17N3O4/c13-8-11(14-3-5-19-6-4-14)9-1-2-12(16)10(7-9)15(17)18/h1-2,7,11,16H,3-6,8,13H2/t11-/m0/s1