1-[(3-chlorophenyl)methyl]-N-(3-propan-2-yloxypropyl)piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(3-chlorophenyl)methyl]-N-(3-propan-2-yloxypropyl)piperidin-1-ium-4-carboxamide Openeye Name: 1-[(3-chlorophenyl)methyl]-N-(3-isopropoxypropyl)piperidin-1-ium-4-carboxamide CAS Name: 1-[(3-chlorophenyl)methyl]-N-(3-propan-2-yloxypropyl)-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(3-chlorophenyl)methyl]-N-(3-propan-2-yloxypropyl)piperidin-1-ium-4-carboxamide Traditional Name: 1-(3-chlorobenzyl)-N-(3-isopropoxypropyl)piperidin-1-ium-4-carboxamide Formula: C19H30ClN2O2+ MolecularWeight: 353.9067

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H29ClN2O2/c1-15(2)24-12-4-9-21-19(23)17-7-10-22(11-8-17)14-16-5-3-6-18(20)13-16/h3,5-6,13,15,17H,4,7-12,14H2,1-2H3,(H,21,23)/p+1