1-ethyl-2-[(R)-(4-methylphenyl)-piperazin-4-ium-1-yl-methyl]benzimidazole

Systemtic Name: 1-ethyl-2-[(R)-(4-methylphenyl)-piperazin-4-ium-1-yl-methyl]benzimidazole Openeye Name: 1-ethyl-2-[(R)-piperazin-4-ium-1-yl(p-tolyl)methyl]benzimidazole CAS Name: 1-ethyl-2-[(R)-(4-methylphenyl)-(1-piperazin-4-iumyl)methyl]benzimidazole IUPAC Name: 1-ethyl-2-[(R)-(4-methylphenyl)-piperazin-4-ium-1-ylmethyl]benzimidazole Traditional Name: 1-ethyl-2-[(R)-piperazin-4-ium-1-yl(p-tolyl)methyl]benzimidazole Formula: C21H27N4+ MolecularWeight: 335.46588

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2N=C1C(C3=CC=C(C=C3)C)N4CC[NH2+]CC4

Isomeric SMILES

CCN1C2=CC=CC=C2N=C1[C@@H](C3=CC=C(C=C3)C)N4CC[NH2+]CC4

InChI

InChI=1S/C21H26N4/c1-3-25-19-7-5-4-6-18(19)23-21(25)20(24-14-12-22-13-15-24)17-10-8-16(2)9-11-17/h4-11,20,22H,3,12-15H2,1-2H3/p+1/t20-/m1/s1