1-[(3-bromophenyl)methyl]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(3-bromophenyl)methyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[(3-bromophenyl)methyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[(3-bromophenyl)methyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(3-bromophenyl)methyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-(3-bromobenzyl)piperidin-1-ium-4-carboxamide Formula: C13H18BrN2O+ MolecularWeight: 298.19882

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)N)CC2=CC(=CC=C2)Br

Isomeric SMILES

C1C[NH+](CCC1C(=O)N)CC2=CC(=CC=C2)Br

InChI

InChI=1S/C13H17BrN2O/c14-12-3-1-2-10(8-12)9-16-6-4-11(5-7-16)13(15)17/h1-3,8,11H,4-7,9H2,(H2,15,17)/p+1