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2-[2-isothiocyanato-1-(2-nitrophenyl)ethoxy]ethyl-trimethyl-azanium

2-[2-isothiocyanato-1-(2-nitrophenyl)ethoxy]ethyl-trimethyl-azanium

Systemtic Name:2-[2-isothiocyanato-1-(2-nitrophenyl)ethoxy]ethyl-trimethyl-azanium
Openeye Name:2-[2-isothiocyanato-1-(2-nitrophenyl)ethoxy]ethyl-trimethyl-ammonium
CAS Name:2-[2-isothiocyanato-1-(2-nitrophenyl)ethoxy]ethyl-trimethylammonium
IUPAC Name:2-[2-isothiocyanato-1-(2-nitrophenyl)ethoxy]ethyl-trimethylazanium
Traditional Name:2-[2-isothiocyanato-1-(2-nitrophenyl)ethoxy]ethyl-trimethyl-ammonium
Formula: C14H20N3O3S+
MolecularWeight: 310.3919
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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CCOC(CN=C=S)C1=CC=CC=C1[N+](=O)[O-]


Isomeric SMILES

C[N+](C)(C)CCOC(CN=C=S)C1=CC=CC=C1[N+](=O)[O-]


InChI

InChI=1S/C14H20N3O3S/c1-17(2,3)8-9-20-14(10-15-11-21)12-6-4-5-7-13(12)16(18)19/h4-7,14H,8-10H2,1-3H3/q+1


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