2-[(4-chloranyl-1,4-dihydro-1,3,5-triazin-2-yl)amino]benzene-1,4-disulfonic acid

Systemtic Name: 2-[(4-chloranyl-1,4-dihydro-1,3,5-triazin-2-yl)amino]benzene-1,4-disulfonic acid Openeye Name: 2-[(4-chloro-1,4-dihydro-1,3,5-triazin-2-yl)amino]benzene-1,4-disulfonic acid CAS Name: 2-[(4-chloro-1,4-dihydro-1,3,5-triazin-2-yl)amino]benzene-1,4-disulfonic acid IUPAC Name: 2-[(4-chloro-1,4-dihydro-1,3,5-triazin-2-yl)amino]benzene-1,4-disulfonic acid Traditional Name: 2-[(4-chloro-1,4-dihydro-s-triazin-2-yl)amino]benzene-1,4-disulfonic acid Formula: C9H9ClN4O6S2 MolecularWeight: 368.77396

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1S(=O)(=O)O)NC2=NC(N=CN2)Cl)S(=O)(=O)O

Isomeric SMILES

C1=CC(=C(C=C1S(=O)(=O)O)NC2=NC(N=CN2)Cl)S(=O)(=O)O

InChI

InChI=1S/C9H9ClN4O6S2/c10-8-11-4-12-9(14-8)13-6-3-5(21(15,16)17)1-2-7(6)22(18,19)20/h1-4,8H,(H,15,16,17)(H,18,19,20)(H2,11,12,13,14)