morpholin-4-ium; (1-phenyl-1,2,3,4-tetrazol-5-yl)-(trifluoromethylsulfonyl)azanide

Systemtic Name: morpholin-4-ium; (1-phenyl-1,2,3,4-tetrazol-5-yl)-(trifluoromethylsulfonyl)azanide Openeye Name: morpholin-4-ium; (1-phenyltetrazol-5-yl)-(trifluoromethylsulfonyl)azanide CAS Name: morpholin-4-ium; (1-phenyl-5-tetrazolyl)-(trifluoromethylsulfonyl)azanide IUPAC Name: morpholin-4-ium; (1-phenyltetrazol-5-yl)-(trifluoromethylsulfonyl)azanide Traditional Name: morpholin-4-ium; (1-phenyltetrazol-5-yl)-triflyl-azanide Formula: C12H15F3N6O3S MolecularWeight: 380.34611

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH2+]1.C1=CC=C(C=C1)N2C(=NN=N2)[N-]S(=O)(=O)C(F)(F)F

Isomeric SMILES

C1COCC[NH2+]1.C1=CC=C(C=C1)N2C(=NN=N2)[N-]S(=O)(=O)C(F)(F)F

InChI

InChI=1S/C8H5F3N5O2S.C4H9NO/c9-8(10,11)19(17,18)13-7-12-14-15-16(7)6-4-2-1-3-5-6;1-3-6-4-2-5-1/h1-5H;5H,1-4H2/q-1;/p+1