3-[2-[3,5-bis(chloranyl)-4-oxidanylidene-3H-pyridin-1-ium-1-yl]ethanoylamino]-2-oxidanylidene-azetidine-1-sulfonic acid

Systemtic Name: 3-[2-[3,5-bis(chloranyl)-4-oxidanylidene-3H-pyridin-1-ium-1-yl]ethanoylamino]-2-oxidanylidene-azetidine-1-sulfonic acid Openeye Name: 3-[[2-(3,5-dichloro-4-oxo-3H-pyridin-1-ium-1-yl)acetyl]amino]-2-oxo-azetidine-1-sulfonic acid CAS Name: 3-[[2-(3,5-dichloro-4-oxo-3H-pyridin-1-ium-1-yl)-1-oxoethyl]amino]-2-oxo-1-azetidinesulfonic acid IUPAC Name: 3-[[2-(3,5-dichloro-4-oxo-3H-pyridin-1-ium-1-yl)acetyl]amino]-2-oxoazetidine-1-sulfonic acid Traditional Name: 3-[[2-(3,5-dichloro-4-keto-3H-pyridin-1-ium-1-yl)acetyl]amino]-2-keto-azetidine-1-sulfonic acid Formula: C10H10Cl2N3O6S+ MolecularWeight: 371.1739

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)N1S(=O)(=O)O)NC(=O)C[N+]2=CC(C(=O)C(=C2)Cl)Cl

Isomeric SMILES

C1C(C(=O)N1S(=O)(=O)O)NC(=O)C[N+]2=CC(C(=O)C(=C2)Cl)Cl

InChI

InChI=1S/C10H9Cl2N3O6S/c11-5-1-14(2-6(12)9(5)17)4-8(16)13-7-3-15(10(7)18)22(19,20)21/h1-2,5,7H,3-4H2,(H-,13,16,19,20,21)/p+1