N-[4-[(R)-(1-ethylbenzimidazol-2-yl)-piperazin-4-ium-1-yl-methyl]phenyl]ethanamide

Systemtic Name: N-[4-[(R)-(1-ethylbenzimidazol-2-yl)-piperazin-4-ium-1-yl-methyl]phenyl]ethanamide Openeye Name: N-[4-[(R)-(1-ethylbenzimidazol-2-yl)-piperazin-4-ium-1-yl-methyl]phenyl]acetamide CAS Name: N-[4-[(R)-(1-ethyl-2-benzimidazolyl)-(1-piperazin-4-iumyl)methyl]phenyl]acetamide IUPAC Name: N-[4-[(R)-(1-ethylbenzimidazol-2-yl)-piperazin-4-ium-1-ylmethyl]phenyl]acetamide Traditional Name: N-[4-[(R)-(1-ethylbenzimidazol-2-yl)-piperazin-4-ium-1-yl-methyl]phenyl]acetamide Formula: C22H28N5O+ MolecularWeight: 378.49062

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27N5O/c1-3-27-20-7-5-4-6-19(20)25-22(27)21(26-14-12-23-13-15-26)17-8-10-18(11-9-17)24-16(2)28/h4-11,21,23H,3,12-15H2,1-2H3,(H,24,28)/p+1/t21-/m1/s1