N-[2-[(4-ethylpiperazin-4-ium-1-yl)methyl]-1-methyl-benzimidazol-5-yl]-2-phenoxy-ethanamide

Systemtic Name: N-[2-[(4-ethylpiperazin-4-ium-1-yl)methyl]-1-methyl-benzimidazol-5-yl]-2-phenoxy-ethanamide Openeye Name: N-[2-[(4-ethylpiperazin-4-ium-1-yl)methyl]-1-methyl-benzimidazol-5-yl]-2-phenoxy-acetamide CAS Name: N-[2-[(4-ethyl-1-piperazin-4-iumyl)methyl]-1-methyl-5-benzimidazolyl]-2-phenoxyacetamide IUPAC Name: N-[2-[(4-ethylpiperazin-4-ium-1-yl)methyl]-1-methylbenzimidazol-5-yl]-2-phenoxyacetamide Traditional Name: N-[2-[(4-ethylpiperazin-4-ium-1-yl)methyl]-1-methyl-benzimidazol-5-yl]-2-phenoxy-acetamide Formula: C23H30N5O2+ MolecularWeight: 408.5166

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)CC2=NC3=C(N2C)C=CC(=C3)NC(=O)COC4=CC=CC=C4

Isomeric SMILES

CC[NH+]1CCN(CC1)CC2=NC3=C(N2C)C=CC(=C3)NC(=O)COC4=CC=CC=C4

InChI

InChI=1S/C23H29N5O2/c1-3-27-11-13-28(14-12-27)16-22-25-20-15-18(9-10-21(20)26(22)2)24-23(29)17-30-19-7-5-4-6-8-19/h4-10,15H,3,11-14,16-17H2,1-2H3,(H,24,29)/p+1