(1-azanyl-2-pyridin-1-ium-1-yl-ethylidene)-(4-chlorophenyl)sulfonyl-azanium

Systemtic Name: (1-azanyl-2-pyridin-1-ium-1-yl-ethylidene)-(4-chlorophenyl)sulfonyl-azanium Openeye Name: (1-amino-2-pyridin-1-ium-1-yl-ethylidene)-(4-chlorophenyl)sulfonyl-ammonium CAS Name: [1-amino-2-(1-pyridin-1-iumyl)ethylidene]-(4-chlorophenyl)sulfonylammonium IUPAC Name: (1-amino-2-pyridin-1-ium-1-ylethylidene)-(4-chlorophenyl)sulfonylazanium Traditional Name: (1-amino-2-pyridin-1-ium-1-yl-ethylidene)-(4-chlorophenyl)sulfonyl-ammonium Formula: C13H14ClN3O2S+2 MolecularWeight: 311.78716

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13ClN3O2S/c14-11-4-6-12(7-5-11)20(18,19)16-13(15)10-17-8-2-1-3-9-17/h1-9H,10H2,(H2,15,16)/q+1/p+1