1-ethyl-2-methyl-N-[[1-(phenylmethyl)piperidin-1-ium-4-ylidene]amino]benzimidazole-5-carboxamide

Systemtic Name: 1-ethyl-2-methyl-N-[[1-(phenylmethyl)piperidin-1-ium-4-ylidene]amino]benzimidazole-5-carboxamide Openeye Name: N-[(1-benzylpiperidin-1-ium-4-ylidene)amino]-1-ethyl-2-methyl-benzimidazole-5-carboxamide CAS Name: 1-ethyl-2-methyl-N-[[1-(phenylmethyl)-4-piperidin-1-iumylidene]amino]-5-benzimidazolecarboxamide IUPAC Name: N-[(1-benzylpiperidin-1-ium-4-ylidene)amino]-1-ethyl-2-methylbenzimidazole-5-carboxamide Traditional Name: N-[(1-benzylpiperidin-1-ium-4-ylidene)amino]-1-ethyl-2-methyl-benzimidazole-5-carboxamide Formula: C23H28N5O+ MolecularWeight: 390.50132

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NC2=C1C=CC(=C2)C(=O)NN=C3CC[NH+](CC3)CC4=CC=CC=C4)C

Isomeric SMILES

CCN1C(=NC2=C1C=CC(=C2)C(=O)NN=C3CC[NH+](CC3)CC4=CC=CC=C4)C

InChI

InChI=1S/C23H27N5O/c1-3-28-17(2)24-21-15-19(9-10-22(21)28)23(29)26-25-20-11-13-27(14-12-20)16-18-7-5-4-6-8-18/h4-10,15H,3,11-14,16H2,1-2H3,(H,26,29)/p+1