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ethyl-[3-(3-nitro-5-oxidanyl-1-benzofuran-2-yl)propyl]azanium

ethyl-[3-(3-nitro-5-oxidanyl-1-benzofuran-2-yl)propyl]azanium

Systemtic Name:ethyl-[3-(3-nitro-5-oxidanyl-1-benzofuran-2-yl)propyl]azanium
Openeye Name:ethyl-[3-(5-hydroxy-3-nitro-benzofuran-2-yl)propyl]ammonium
CAS Name:ethyl-[3-(5-hydroxy-3-nitro-2-benzofuranyl)propyl]ammonium
IUPAC Name:ethyl-[3-(5-hydroxy-3-nitro-1-benzofuran-2-yl)propyl]azanium
Traditional Name:ethyl-[3-(5-hydroxy-3-nitro-benzofuran-2-yl)propyl]ammonium
Formula: C13H17N2O4+
MolecularWeight: 265.28508
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Descriptors Computed from Structure

Canonical SMILES:

CC[NH2+]CCCC1=C(C2=C(O1)C=CC(=C2)O)[N+](=O)[O-]


Isomeric SMILES

CC[NH2+]CCCC1=C(C2=C(O1)C=CC(=C2)O)[N+](=O)[O-]


InChI

InChI=1S/C13H16N2O4/c1-2-14-7-3-4-12-13(15(17)18)10-8-9(16)5-6-11(10)19-12/h5-6,8,14,16H,2-4,7H2,1H3/p+1


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