trimethyl-[[2-[2-[[(E)-2-nitroethenyl]amino]ethylsulfanylmethyl]furan-3-yl]methyl]azanium

Systemtic Name: trimethyl-[[2-[2-[[(E)-2-nitroethenyl]amino]ethylsulfanylmethyl]furan-3-yl]methyl]azanium Openeye Name: trimethyl-[[2-[2-[[(E)-2-nitrovinyl]amino]ethylsulfanylmethyl]-3-furyl]methyl]ammonium CAS Name: trimethyl-[[2-[[2-[[(E)-2-nitroethenyl]amino]ethylthio]methyl]-3-furanyl]methyl]ammonium IUPAC Name: trimethyl-[[2-[2-[[(E)-2-nitroethenyl]amino]ethylsulfanylmethyl]furan-3-yl]methyl]azanium Traditional Name: trimethyl-[[2-[[2-[[(E)-2-nitrovinyl]amino]ethylthio]methyl]-3-furyl]methyl]ammonium Formula: C13H22N3O3S+ MolecularWeight: 300.39708

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CC1=C(OC=C1)CSCCNC=C[N+](=O)[O-]

Isomeric SMILES

C[N+](C)(C)CC1=C(OC=C1)CSCCN/C=C/[N+](=O)[O-]

InChI

InChI=1S/C13H22N3O3S/c1-16(2,3)10-12-4-8-19-13(12)11-20-9-6-14-5-7-15(17)18/h4-5,7-8,14H,6,9-11H2,1-3H3/q+1/b7-5+