1-butyl-2-heptyl-3-(phenylmethyl)-4,5-dihydroimidazol-3-ium

Systemtic Name: 1-butyl-2-heptyl-3-(phenylmethyl)-4,5-dihydroimidazol-3-ium Openeye Name: 1-benzyl-3-butyl-2-heptyl-4,5-dihydroimidazol-1-ium CAS Name: 1-butyl-2-heptyl-3-(phenylmethyl)-4,5-dihydroimidazol-3-ium IUPAC Name: 1-benzyl-3-butyl-2-heptyl-4,5-dihydroimidazol-1-ium Traditional Name: 1-benzyl-3-butyl-2-heptyl-2-imidazolin-1-ium Formula: C21H35N2+ MolecularWeight: 315.516

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=[N+](CCN1CCCC)CC2=CC=CC=C2

Isomeric SMILES

CCCCCCCC1=[N+](CCN1CCCC)CC2=CC=CC=C2

InChI

InChI=1S/C21H35N2/c1-3-5-7-8-12-15-21-22(16-6-4-2)17-18-23(21)19-20-13-10-9-11-14-20/h9-11,13-14H,3-8,12,15-19H2,1-2H3/q+1