1-[2-[methyl-[2-(methylamino)-2-oxidanylidene-ethyl]amino]-2-oxidanylidene-ethyl]-N-phenyl-piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[2-[methyl-[2-(methylamino)-2-oxidanylidene-ethyl]amino]-2-oxidanylidene-ethyl]-N-phenyl-piperidin-1-ium-4-carboxamide Openeye Name: 1-[2-[methyl-[2-(methylamino)-2-oxo-ethyl]amino]-2-oxo-ethyl]-N-phenyl-piperidin-1-ium-4-carboxamide CAS Name: 1-[2-[methyl-[2-(methylamino)-2-oxoethyl]amino]-2-oxoethyl]-N-phenyl-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[2-[methyl-[2-(methylamino)-2-oxoethyl]amino]-2-oxoethyl]-N-phenylpiperidin-1-ium-4-carboxamide Traditional Name: 1-[2-keto-2-[[2-keto-2-(methylamino)ethyl]-methyl-amino]ethyl]-N-phenyl-piperidin-1-ium-4-carboxamide Formula: C18H27N4O3+ MolecularWeight: 347.43198

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)CN(C)C(=O)C[NH+]1CCC(CC1)C(=O)NC2=CC=CC=C2

Isomeric SMILES

CNC(=O)CN(C)C(=O)C[NH+]1CCC(CC1)C(=O)NC2=CC=CC=C2

InChI

InChI=1S/C18H26N4O3/c1-19-16(23)12-21(2)17(24)13-22-10-8-14(9-11-22)18(25)20-15-6-4-3-5-7-15/h3-7,14H,8-13H2,1-2H3,(H,19,23)(H,20,25)/p+1