1-oxidanidyl-N-[4-(2-phenylazanylpyridin-4-yl)pyridin-2-yl]pyridin-1-ium-4-carboxamide

Systemtic Name: 1-oxidanidyl-N-[4-(2-phenylazanylpyridin-4-yl)pyridin-2-yl]pyridin-1-ium-4-carboxamide Openeye Name: N-[4-(2-anilino-4-pyridyl)-2-pyridyl]-1-oxido-pyridin-1-ium-4-carboxamide CAS Name: N-[4-(2-anilino-4-pyridinyl)-2-pyridinyl]-1-oxido-4-pyridin-1-iumcarboxamide IUPAC Name: N-[4-(2-anilinopyridin-4-yl)pyridin-2-yl]-1-oxidopyridin-1-ium-4-carboxamide Traditional Name: N-[4-(2-anilino-4-pyridyl)-2-pyridyl]-1-oxido-pyridin-1-ium-4-carboxamide Formula: C22H17N5O2 MolecularWeight: 383.40268

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NC=CC(=C2)C3=CC(=NC=C3)NC(=O)C4=CC=[N+](C=C4)[O-]

Isomeric SMILES

C1=CC=C(C=C1)NC2=NC=CC(=C2)C3=CC(=NC=C3)NC(=O)C4=CC=[N+](C=C4)[O-]

InChI

InChI=1S/C22H17N5O2/c28-22(16-8-12-27(29)13-9-16)26-21-15-18(7-11-24-21)17-6-10-23-20(14-17)25-19-4-2-1-3-5-19/h1-15H,(H,23,25)(H,24,26,28)