1-[(2S)-pentan-2-yl]-2,4,6-triphenyl-pyridin-1-ium

Systemtic Name: 1-[(2S)-pentan-2-yl]-2,4,6-triphenyl-pyridin-1-ium Openeye Name: 1-[(1S)-1-methylbutyl]-2,4,6-triphenyl-pyridin-1-ium CAS Name: 1-[(2S)-pentan-2-yl]-2,4,6-triphenylpyridin-1-ium IUPAC Name: 1-[(2S)-pentan-2-yl]-2,4,6-triphenylpyridin-1-ium Traditional Name: 1-[(1S)-1-methylbutyl]-2,4,6-triphenyl-pyridin-1-ium Formula: C28H28N+ MolecularWeight: 378.52862

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)[N+]1=C(C=C(C=C1C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCC[C@H](C)[N+]1=C(C=C(C=C1C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C28H28N/c1-3-13-22(2)29-27(24-16-9-5-10-17-24)20-26(23-14-7-4-8-15-23)21-28(29)25-18-11-6-12-19-25/h4-12,14-22H,3,13H2,1-2H3/q+1/t22-/m0/s1