(Z)-2-chloranyl-3-phenyl-N-(4-pyridin-1-ium-2-ylpiperazin-1-yl)prop-2-en-1-imine

Systemtic Name: (Z)-2-chloranyl-3-phenyl-N-(4-pyridin-1-ium-2-ylpiperazin-1-yl)prop-2-en-1-imine Openeye Name: (Z)-2-chloro-3-phenyl-N-(4-pyridin-1-ium-2-ylpiperazin-1-yl)prop-2-en-1-imine CAS Name: (Z)-2-chloro-3-phenyl-N-[4-(2-pyridin-1-iumyl)-1-piperazinyl]-2-propen-1-imine IUPAC Name: (Z)-2-chloro-3-phenyl-N-(4-pyridin-1-ium-2-ylpiperazin-1-yl)prop-2-en-1-imine Traditional Name: (E)-[(Z)-2-chloro-3-phenyl-prop-2-enylidene]-(4-pyridin-1-ium-2-ylpiperazino)amine Formula: C18H20ClN4+ MolecularWeight: 327.8312

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=[NH+]2)N=CC(=CC3=CC=CC=C3)Cl

Isomeric SMILES

C1CN(CCN1C2=CC=CC=[NH+]2)/N=C/C(=C/C3=CC=CC=C3)/Cl

InChI

InChI=1S/C18H19ClN4/c19-17(14-16-6-2-1-3-7-16)15-21-23-12-10-22(11-13-23)18-8-4-5-9-20-18/h1-9,14-15H,10-13H2/p+1/b17-14-,21-15+