1-[[2,3-bis(chloranyl)phenyl]methyl]-N-(3-butoxypropyl)piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[[2,3-bis(chloranyl)phenyl]methyl]-N-(3-butoxypropyl)piperidin-1-ium-4-carboxamide Openeye Name: N-(3-butoxypropyl)-1-[(2,3-dichlorophenyl)methyl]piperidin-1-ium-4-carboxamide CAS Name: N-(3-butoxypropyl)-1-[(2,3-dichlorophenyl)methyl]-4-piperidin-1-iumcarboxamide IUPAC Name: N-(3-butoxypropyl)-1-[(2,3-dichlorophenyl)methyl]piperidin-1-ium-4-carboxamide Traditional Name: N-(3-butoxypropyl)-1-(2,3-dichlorobenzyl)piperidin-1-ium-4-carboxamide Formula: C20H31Cl2N2O2+ MolecularWeight: 402.37834

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H30Cl2N2O2/c1-2-3-13-26-14-5-10-23-20(25)16-8-11-24(12-9-16)15-17-6-4-7-18(21)19(17)22/h4,6-7,16H,2-3,5,8-15H2,1H3,(H,23,25)/p+1