2-[(R)-(3-bromophenyl)-piperazin-4-ium-1-yl-methyl]-1-methyl-benzimidazole

Systemtic Name: 2-[(R)-(3-bromophenyl)-piperazin-4-ium-1-yl-methyl]-1-methyl-benzimidazole Openeye Name: 2-[(R)-(3-bromophenyl)-piperazin-4-ium-1-yl-methyl]-1-methyl-benzimidazole CAS Name: 2-[(R)-(3-bromophenyl)-(1-piperazin-4-iumyl)methyl]-1-methylbenzimidazole IUPAC Name: 2-[(R)-(3-bromophenyl)-piperazin-4-ium-1-ylmethyl]-1-methylbenzimidazole Traditional Name: 2-[(R)-(3-bromophenyl)-piperazin-4-ium-1-yl-methyl]-1-methyl-benzimidazole Formula: C19H22BrN4+ MolecularWeight: 386.30878

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N=C1C(C3=CC(=CC=C3)Br)N4CC[NH2+]CC4

Isomeric SMILES

CN1C2=CC=CC=C2N=C1[C@@H](C3=CC(=CC=C3)Br)N4CC[NH2+]CC4

InChI

InChI=1S/C19H21BrN4/c1-23-17-8-3-2-7-16(17)22-19(23)18(24-11-9-21-10-12-24)14-5-4-6-15(20)13-14/h2-8,13,18,21H,9-12H2,1H3/p+1/t18-/m1/s1