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

Systemtic Name: 1-ethyl-2-[(R)-(3-methoxyphenyl)-piperazin-4-ium-1-yl-methyl]benzimidazole Openeye Name: 1-ethyl-2-[(R)-(3-methoxyphenyl)-piperazin-4-ium-1-yl-methyl]benzimidazole CAS Name: 1-ethyl-2-[(R)-(3-methoxyphenyl)-(1-piperazin-4-iumyl)methyl]benzimidazole IUPAC Name: 1-ethyl-2-[(R)-(3-methoxyphenyl)-piperazin-4-ium-1-ylmethyl]benzimidazole Traditional Name: 1-ethyl-2-[(R)-(3-methoxyphenyl)-piperazin-4-ium-1-yl-methyl]benzimidazole Formula: C21H27N4O+ MolecularWeight: 351.46528

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26N4O/c1-3-25-19-10-5-4-9-18(19)23-21(25)20(24-13-11-22-12-14-24)16-7-6-8-17(15-16)26-2/h4-10,15,20,22H,3,11-14H2,1-2H3/p+1/t20-/m1/s1