1-(phenylmethyl)pyridin-1-ium-3-carboxamide bromide

Systemtic Name: 1-(phenylmethyl)pyridin-1-ium-3-carboxamide bromide Openeye Name: 1-benzylpyridin-1-ium-3-carboxamide bromide CAS Name: 1-(phenylmethyl)-3-pyridin-1-iumcarboxamide bromide IUPAC Name: 1-benzylpyridin-1-ium-3-carboxamide bromide Traditional Name: 1-benzylpyridin-1-ium-3-carboxamide bromide Formula: C13H13BrN2O MolecularWeight: 294.152529

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C[N+]2=CC=CC(=C2)C(=O)N.[Br-]

Isomeric SMILES

C1=CC=C(C=C1)C[15N+]2=CC=CC(=C2)C(=O)N.[Br-]

InChI

InChI=1S/C13H12N2O.BrH/c14-13(16)12-7-4-8-15(10-12)9-11-5-2-1-3-6-11;/h1-8,10H,9H2,(H-,14,16);1H/i15+1;