1,1,2-trimethylbenzo[e]indole-6,8-disulfonic acid

Systemtic Name: 1,1,2-trimethylbenzo[e]indole-6,8-disulfonic acid Openeye Name: 1,1,2-trimethylbenzo[e]indole-6,8-disulfonic acid CAS Name: 1,1,2-trimethylbenzo[e]indole-6,8-disulfonic acid IUPAC Name: 1,1,2-trimethylbenzo[e]indole-6,8-disulfonic acid Traditional Name: 1,1,2-trimethylbenz[e]indole-6,8-disulfonic acid Formula: C15H15NO6S2 MolecularWeight: 369.4127

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C1(C)C)C3=CC(=CC(=C3C=C2)S(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

CC1=NC2=C(C1(C)C)C3=CC(=CC(=C3C=C2)S(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C15H15NO6S2/c1-8-15(2,3)14-11-6-9(23(17,18)19)7-13(24(20,21)22)10(11)4-5-12(14)16-8/h4-7H,1-3H3,(H,17,18,19)(H,20,21,22)