N-(2-azanyl-1-phenyl-ethyl)-1-oxidanidyl-pyridin-1-ium-2-carboxamide

Systemtic Name: N-(2-azanyl-1-phenyl-ethyl)-1-oxidanidyl-pyridin-1-ium-2-carboxamide Openeye Name: N-(2-amino-1-phenyl-ethyl)-1-oxido-pyridin-1-ium-2-carboxamide CAS Name: N-(2-amino-1-phenylethyl)-1-oxido-2-pyridin-1-iumcarboxamide IUPAC Name: N-(2-amino-1-phenylethyl)-1-oxidopyridin-1-ium-2-carboxamide Traditional Name: N-(2-amino-1-phenyl-ethyl)-1-oxido-pyridin-1-ium-2-carboxamide Formula: C14H15N3O2 MolecularWeight: 257.2878

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CN)NC(=O)C2=CC=CC=[N+]2[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(CN)NC(=O)C2=CC=CC=[N+]2[O-]

InChI

InChI=1S/C14H15N3O2/c15-10-12(11-6-2-1-3-7-11)16-14(18)13-8-4-5-9-17(13)19/h1-9,12H,10,15H2,(H,16,18)