N-(2-chloranyl-4-nitro-phenyl)-N'-pyridin-1-ium-2-yl-ethane-1,2-diamine

Systemtic Name: N-(2-chloranyl-4-nitro-phenyl)-N'-pyridin-1-ium-2-yl-ethane-1,2-diamine Openeye Name: N-(2-chloro-4-nitro-phenyl)-N'-pyridin-1-ium-2-yl-ethane-1,2-diamine CAS Name: N-(2-chloro-4-nitrophenyl)-N'-(2-pyridin-1-iumyl)ethane-1,2-diamine IUPAC Name: N-(2-chloro-4-nitrophenyl)-N'-pyridin-1-ium-2-ylethane-1,2-diamine Traditional Name: 2-(2-chloro-4-nitro-anilino)ethyl-pyridin-1-ium-2-yl-amine Formula: C13H14ClN4O2+ MolecularWeight: 293.72886

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[NH+]C(=C1)NCCNC2=C(C=C(C=C2)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC=[NH+]C(=C1)NCCNC2=C(C=C(C=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C13H13ClN4O2/c14-11-9-10(18(19)20)4-5-12(11)15-7-8-17-13-3-1-2-6-16-13/h1-6,9,15H,7-8H2,(H,16,17)/p+1