1-(4,5-dihydro-1H-imidazol-1-ium-2-ylmethyl)-3-ethyl-indole chloride

Systemtic Name: 1-(4,5-dihydro-1H-imidazol-1-ium-2-ylmethyl)-3-ethyl-indole chloride Openeye Name: 1-(4,5-dihydro-1H-imidazol-1-ium-2-ylmethyl)-3-ethyl-indole chloride CAS Name: 1-(4,5-dihydro-1H-imidazol-1-ium-2-ylmethyl)-3-ethylindole chloride IUPAC Name: 1-(4,5-dihydro-1H-imidazol-1-ium-2-ylmethyl)-3-ethylindole chloride Traditional Name: 3-ethyl-1-(2-imidazolin-1-ium-2-ylmethyl)indole chloride Formula: C14H18ClN3 MolecularWeight: 263.76582

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CN(C2=CC=CC=C21)CC3=NCC[NH2+]3.[Cl-]

Isomeric SMILES

CCC1=CN(C2=CC=CC=C21)CC3=NCC[NH2+]3.[Cl-]

InChI

InChI=1S/C14H17N3.ClH/c1-2-11-9-17(10-14-15-7-8-16-14)13-6-4-3-5-12(11)13;/h3-6,9H,2,7-8,10H2,1H3,(H,15,16);1H