2-azanyl-5-chloranyl-1-(phenylmethyl)pyridin-1-ium-3-carboxamide

Systemtic Name: 2-azanyl-5-chloranyl-1-(phenylmethyl)pyridin-1-ium-3-carboxamide Openeye Name: 2-amino-1-benzyl-5-chloro-pyridin-1-ium-3-carboxamide CAS Name: 2-amino-5-chloro-1-(phenylmethyl)-3-pyridin-1-iumcarboxamide IUPAC Name: 2-amino-1-benzyl-5-chloropyridin-1-ium-3-carboxamide Traditional Name: 2-amino-1-benzyl-5-chloro-pyridin-1-ium-3-carboxamide Formula: C13H13ClN3O+ MolecularWeight: 262.71482

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C[N+]2=C(C(=CC(=C2)Cl)C(=O)N)N

Isomeric SMILES

C1=CC=C(C=C1)C[N+]2=C(C(=CC(=C2)Cl)C(=O)N)N

InChI

InChI=1S/C13H12ClN3O/c14-10-6-11(13(16)18)12(15)17(8-10)7-9-4-2-1-3-5-9/h1-6,8,15H,7H2,(H2,16,18)/p+1