(E)-1-(2,3-dibutylpyridin-1-ium-1-yl)-2-phenyl-ethenamine

Systemtic Name: (E)-1-(2,3-dibutylpyridin-1-ium-1-yl)-2-phenyl-ethenamine Openeye Name: (E)-1-(2,3-dibutylpyridin-1-ium-1-yl)-2-phenyl-ethenamine CAS Name: (E)-1-(2,3-dibutyl-1-pyridin-1-iumyl)-2-phenylethenamine IUPAC Name: (E)-1-(2,3-dibutylpyridin-1-ium-1-yl)-2-phenylethenamine Traditional Name: [(E)-1-(2,3-dibutylpyridin-1-ium-1-yl)-2-phenyl-vinyl]amine Formula: C21H29N2+ MolecularWeight: 309.46836

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C([N+](=CC=C1)C(=CC2=CC=CC=C2)N)CCCC

Isomeric SMILES

CCCCC1=C([N+](=CC=C1)/C(=C/C2=CC=CC=C2)/N)CCCC

InChI

InChI=1S/C21H29N2/c1-3-5-13-19-14-10-16-23(20(19)15-6-4-2)21(22)17-18-11-8-7-9-12-18/h7-12,14,16-17H,3-6,13,15,22H2,1-2H3/q+1/b21-17+