[(Z)-1-azanyl-3-[pyridin-1-ium-2-yl(pyridin-3-ylmethyl)amino]prop-1-enyl]azanium

Systemtic Name: [(Z)-1-azanyl-3-[pyridin-1-ium-2-yl(pyridin-3-ylmethyl)amino]prop-1-enyl]azanium Openeye Name: [(Z)-1-amino-3-[pyridin-1-ium-2-yl(3-pyridylmethyl)amino]prop-1-enyl]ammonium CAS Name: [(Z)-1-amino-3-[2-pyridin-1-iumyl(3-pyridinylmethyl)amino]prop-1-enyl]ammonium IUPAC Name: [(Z)-1-amino-3-[pyridin-1-ium-2-yl(pyridin-3-ylmethyl)amino]prop-1-enyl]azanium Traditional Name: [(Z)-1-amino-3-[pyridin-1-ium-2-yl(3-pyridylmethyl)amino]prop-1-enyl]ammonium Formula: C14H19N5+2 MolecularWeight: 257.33416

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[NH+]C(=C1)N(CC=C([NH3+])N)CC2=CN=CC=C2

Isomeric SMILES

C1=CC=[NH+]C(=C1)N(C/C=C(\[NH3+])/N)CC2=CN=CC=C2

InChI

InChI=1S/C14H17N5/c15-13(16)6-9-19(14-5-1-2-8-18-14)11-12-4-3-7-17-10-12/h1-8,10H,9,11,15-16H2/p+2