1-(phenylmethyl)pyridin-1-ium-3-carboxamide hexafluorophosphate

Systemtic Name: 1-(phenylmethyl)pyridin-1-ium-3-carboxamide hexafluorophosphate Openeye Name: 1-benzylpyridin-1-ium-3-carboxamide hexafluorophosphate CAS Name: 1-(phenylmethyl)-3-pyridin-1-iumcarboxamide hexafluorophosphate IUPAC Name: 1-benzylpyridin-1-ium-3-carboxamide hexafluorophosphate Traditional Name: 1-benzylpyridin-1-ium-3-carboxamide hexafluorophosphate Formula: C13H13F6N2OP MolecularWeight: 358.2193

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C[N+]2=CC=CC(=C2)C(=O)N.F[P-](F)(F)(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)C[N+]2=CC=CC(=C2)C(=O)N.F[P-](F)(F)(F)(F)F

InChI

InChI=1S/C13H12N2O.F6P/c14-13(16)12-7-4-8-15(10-12)9-11-5-2-1-3-6-11;1-7(2,3,4,5)6/h1-8,10H,9H2,(H-,14,16);/q;-1/p+1