1-[2-[(3,4-dichlorophenyl)methyl-methyl-amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[2-[(3,4-dichlorophenyl)methyl-methyl-amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[2-[(3,4-dichlorophenyl)methyl-methyl-amino]-2-oxo-ethyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[2-[(3,4-dichlorophenyl)methyl-methylamino]-2-oxoethyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[2-[(3,4-dichlorophenyl)methyl-methylamino]-2-oxoethyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-[2-[(3,4-dichlorobenzyl)-methyl-amino]-2-keto-ethyl]piperidin-1-ium-4-carboxamide Formula: C16H22Cl2N3O2+ MolecularWeight: 359.27078

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=C(C=C1)Cl)Cl)C(=O)C[NH+]2CCC(CC2)C(=O)N

Isomeric SMILES

CN(CC1=CC(=C(C=C1)Cl)Cl)C(=O)C[NH+]2CCC(CC2)C(=O)N

InChI

InChI=1S/C16H21Cl2N3O2/c1-20(9-11-2-3-13(17)14(18)8-11)15(22)10-21-6-4-12(5-7-21)16(19)23/h2-3,8,12H,4-7,9-10H2,1H3,(H2,19,23)/p+1