[benzotriazol-1-yl-bis(dimethylamino)methyl]oxidanium hexafluorophosphate

Systemtic Name: [benzotriazol-1-yl-bis(dimethylamino)methyl]oxidanium hexafluorophosphate Openeye Name: [benzotriazol-1-yl-bis(dimethylamino)methyl]oxonium hexafluorophosphate CAS Name: [1-benzotriazolyl-bis(dimethylamino)methyl]oxonium hexafluorophosphate IUPAC Name: [benzotriazol-1-yl-bis(dimethylamino)methyl]oxidanium hexafluorophosphate Traditional Name: [benzotriazol-1-yl-bis(dimethylamino)methyl]oxonium hexafluorophosphate Formula: C11H18F6N5OP MolecularWeight: 381.2577

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(N1C2=CC=CC=C2N=N1)(N(C)C)[OH2+].F[P-](F)(F)(F)(F)F

Isomeric SMILES

CN(C)C(N1C2=CC=CC=C2N=N1)(N(C)C)[OH2+].F[P-](F)(F)(F)(F)F

InChI

InChI=1S/C11H17N5O.F6P/c1-14(2)11(17,15(3)4)16-10-8-6-5-7-9(10)12-13-16;1-7(2,3,4,5)6/h5-8,17H,1-4H3;/q;-1/p+1