N-[1-methyl-2-[[4-(phenylmethyl)piperazin-4-ium-1-yl]methyl]benzimidazol-5-yl]propanamide

Systemtic Name: N-[1-methyl-2-[[4-(phenylmethyl)piperazin-4-ium-1-yl]methyl]benzimidazol-5-yl]propanamide Openeye Name: N-[2-[(4-benzylpiperazin-4-ium-1-yl)methyl]-1-methyl-benzimidazol-5-yl]propanamide CAS Name: N-[1-methyl-2-[[4-(phenylmethyl)-1-piperazin-4-iumyl]methyl]-5-benzimidazolyl]propanamide IUPAC Name: N-[2-[(4-benzylpiperazin-4-ium-1-yl)methyl]-1-methylbenzimidazol-5-yl]propanamide Traditional Name: N-[2-[(4-benzylpiperazin-4-ium-1-yl)methyl]-1-methyl-benzimidazol-5-yl]propionamide Formula: C23H30N5O+ MolecularWeight: 392.5172

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC2=C(C=C1)N(C(=N2)CN3CC[NH+](CC3)CC4=CC=CC=C4)C

Isomeric SMILES

CCC(=O)NC1=CC2=C(C=C1)N(C(=N2)CN3CC[NH+](CC3)CC4=CC=CC=C4)C

InChI

InChI=1S/C23H29N5O/c1-3-23(29)24-19-9-10-21-20(15-19)25-22(26(21)2)17-28-13-11-27(12-14-28)16-18-7-5-4-6-8-18/h4-10,15H,3,11-14,16-17H2,1-2H3,(H,24,29)/p+1