methyl 1-[(3,4-dichlorophenyl)methyl]piperidin-1-ium-4-carboxylate

Systemtic Name: methyl 1-[(3,4-dichlorophenyl)methyl]piperidin-1-ium-4-carboxylate Openeye Name: methyl 1-[(3,4-dichlorophenyl)methyl]piperidin-1-ium-4-carboxylate CAS Name: 1-[(3,4-dichlorophenyl)methyl]-4-piperidin-1-iumcarboxylic acid methyl ester IUPAC Name: methyl 1-[(3,4-dichlorophenyl)methyl]piperidin-1-ium-4-carboxylate Traditional Name: 1-(3,4-dichlorobenzyl)piperidin-1-ium-4-carboxylic acid methyl ester Formula: C14H18Cl2NO2+ MolecularWeight: 303.20422

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC[NH+](CC1)CC2=CC(=C(C=C2)Cl)Cl

Isomeric SMILES

COC(=O)C1CC[NH+](CC1)CC2=CC(=C(C=C2)Cl)Cl

InChI

InChI=1S/C14H17Cl2NO2/c1-19-14(18)11-4-6-17(7-5-11)9-10-2-3-12(15)13(16)8-10/h2-3,8,11H,4-7,9H2,1H3/p+1