1-[(3-chlorophenyl)methyl]-N-[2-(cyclohexen-1-yl)ethyl]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(3-chlorophenyl)methyl]-N-[2-(cyclohexen-1-yl)ethyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[(3-chlorophenyl)methyl]-N-[2-(cyclohexen-1-yl)ethyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[(3-chlorophenyl)methyl]-N-[2-(1-cyclohexenyl)ethyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(3-chlorophenyl)methyl]-N-[2-(cyclohexen-1-yl)ethyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-(3-chlorobenzyl)-N-[2-(cyclohexen-1-yl)ethyl]piperidin-1-ium-4-carboxamide Formula: C21H30ClN2O+ MolecularWeight: 361.9287

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=CC1)CCNC(=O)C2CC[NH+](CC2)CC3=CC(=CC=C3)Cl

Isomeric SMILES

C1CCC(=CC1)CCNC(=O)C2CC[NH+](CC2)CC3=CC(=CC=C3)Cl

InChI

InChI=1S/C21H29ClN2O/c22-20-8-4-7-18(15-20)16-24-13-10-19(11-14-24)21(25)23-12-9-17-5-2-1-3-6-17/h4-5,7-8,15,19H,1-3,6,9-14,16H2,(H,23,25)/p+1