N-[(2-chlorophenyl)methyl]-1-(2-methylpropyl)piperidin-1-ium-4-carboxamide

Systemtic Name: N-[(2-chlorophenyl)methyl]-1-(2-methylpropyl)piperidin-1-ium-4-carboxamide Openeye Name: N-[(2-chlorophenyl)methyl]-1-isobutyl-piperidin-1-ium-4-carboxamide CAS Name: N-[(2-chlorophenyl)methyl]-1-(2-methylpropyl)-4-piperidin-1-iumcarboxamide IUPAC Name: N-[(2-chlorophenyl)methyl]-1-(2-methylpropyl)piperidin-1-ium-4-carboxamide Traditional Name: N-(2-chlorobenzyl)-1-isobutyl-piperidin-1-ium-4-carboxamide Formula: C17H26ClN2O+ MolecularWeight: 309.85414

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C[NH+]1CCC(CC1)C(=O)NCC2=CC=CC=C2Cl

Isomeric SMILES

CC(C)C[NH+]1CCC(CC1)C(=O)NCC2=CC=CC=C2Cl

InChI

InChI=1S/C17H25ClN2O/c1-13(2)12-20-9-7-14(8-10-20)17(21)19-11-15-5-3-4-6-16(15)18/h3-6,13-14H,7-12H2,1-2H3,(H,19,21)/p+1