1-(3-nitrophenyl)sulfonyl-4-pyridin-1-ium-2-yl-piperazine

Systemtic Name: 1-(3-nitrophenyl)sulfonyl-4-pyridin-1-ium-2-yl-piperazine Openeye Name: 1-(3-nitrophenyl)sulfonyl-4-pyridin-1-ium-2-yl-piperazine CAS Name: 1-(3-nitrophenyl)sulfonyl-4-(2-pyridin-1-iumyl)piperazine IUPAC Name: 1-(3-nitrophenyl)sulfonyl-4-pyridin-1-ium-2-ylpiperazine Traditional Name: 1-(3-nitrophenyl)sulfonyl-4-pyridin-1-ium-2-yl-piperazine Formula: C15H17N4O4S+ MolecularWeight: 349.38488

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=[NH+]2)S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=CC=CC=[NH+]2)S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H16N4O4S/c20-19(21)13-4-3-5-14(12-13)24(22,23)18-10-8-17(9-11-18)15-6-1-2-7-16-15/h1-7,12H,8-11H2/p+1