N2-[3-[(E)-2-(1-oxidanidylpyridin-1-ium-4-yl)ethenyl]phenyl]pyridine-2,3-diamine

Systemtic Name: N2-[3-[(E)-2-(1-oxidanidylpyridin-1-ium-4-yl)ethenyl]phenyl]pyridine-2,3-diamine Openeye Name: N2-[3-[(E)-2-(1-oxidopyridin-1-ium-4-yl)vinyl]phenyl]pyridine-2,3-diamine CAS Name: N2-[3-[(E)-2-(1-oxido-4-pyridin-1-iumyl)ethenyl]phenyl]pyridine-2,3-diamine IUPAC Name: 2-N-[3-[(E)-2-(1-oxidopyridin-1-ium-4-yl)ethenyl]phenyl]pyridine-2,3-diamine Traditional Name: (3-amino-2-pyridyl)-[3-[(E)-2-(1-oxidopyridin-1-ium-4-yl)vinyl]phenyl]amine Formula: C18H16N4O MolecularWeight: 304.34584

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC2=C(C=CC=N2)N)C=CC3=CC=[N+](C=C3)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)NC2=C(C=CC=N2)N)/C=C/C3=CC=[N+](C=C3)[O-]

InChI

InChI=1S/C18H16N4O/c19-17-5-2-10-20-18(17)21-16-4-1-3-15(13-16)7-6-14-8-11-22(23)12-9-14/h1-13H,19H2,(H,20,21)/b7-6+