2-ethoxyethyl N-methyl-N-(1-methylpiperidin-1-ium-4-yl)-N'-[4-(trifluoromethyl)phenyl]carbonyl-carbamimidate

Systemtic Name: 2-ethoxyethyl N-methyl-N-(1-methylpiperidin-1-ium-4-yl)-N'-[4-(trifluoromethyl)phenyl]carbonyl-carbamimidate Openeye Name: N-[2-ethoxyethoxy-[methyl-(1-methylpiperidin-1-ium-4-yl)amino]methylene]-4-(trifluoromethyl)benzamide CAS Name: N-methyl-N-(1-methyl-4-piperidin-1-iumyl)-N'-[oxo-[4-(trifluoromethyl)phenyl]methyl]carbamimidic acid 2-ethoxyethyl ester IUPAC Name: 2-ethoxyethyl N-methyl-N-(1-methylpiperidin-1-ium-4-yl)-N'-[4-(trifluoromethyl)benzoyl]carbamimidate Traditional Name: N-[2-ethoxyethoxy-[methyl-(1-methylpiperidin-1-ium-4-yl)amino]methylene]-4-(trifluoromethyl)benzamide Formula: C20H29F3N3O3+ MolecularWeight: 416.45777

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCOC(=NC(=O)C1=CC=C(C=C1)C(F)(F)F)N(C)C2CC[NH+](CC2)C

Isomeric SMILES

CCOCCOC(=NC(=O)C1=CC=C(C=C1)C(F)(F)F)N(C)C2CC[NH+](CC2)C

InChI

InChI=1S/C20H28F3N3O3/c1-4-28-13-14-29-19(26(3)17-9-11-25(2)12-10-17)24-18(27)15-5-7-16(8-6-15)20(21,22)23/h5-8,17H,4,9-14H2,1-3H3/p+1