2-methyl-1-phenethyl-4-(propylamino)pyridin-1-ium-3-ol tetrafluoroborate

Systemtic Name: 2-methyl-1-phenethyl-4-(propylamino)pyridin-1-ium-3-ol tetrafluoroborate Openeye Name: 2-methyl-1-phenethyl-4-(propylamino)pyridin-1-ium-3-ol tetrafluoroborate CAS Name: 2-methyl-1-phenethyl-4-(propylamino)-3-pyridin-1-iumol tetrafluoroborate IUPAC Name: 2-methyl-1-phenethyl-4-(propylamino)pyridin-1-ium-3-ol tetrafluoroborate Traditional Name: 2-methyl-1-phenethyl-4-(propylamino)pyridin-1-ium-3-ol tetrafluoroborate Formula: C17H23BF4N2O MolecularWeight: 358.181933

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.CCCNC1=C(C(=[N+](C=C1)CCC2=CC=CC=C2)C)O

Isomeric SMILES

[B-](F)(F)(F)F.CCCNC1=C(C(=[N+](C=C1)CCC2=CC=CC=C2)C)O

InChI

InChI=1S/C17H22N2O.BF4/c1-3-11-18-16-10-13-19(14(2)17(16)20)12-9-15-7-5-4-6-8-15;2-1(3,4)5/h4-8,10,13,20H,3,9,11-12H2,1-2H3;/q;-1/p+1