sodium 1,1,2-trimethylbenzo[e]indole-7-sulfonic acid

Systemtic Name: sodium 1,1,2-trimethylbenzo[e]indole-7-sulfonic acid Openeye Name: sodium 1,1,2-trimethylbenzo[e]indole-7-sulfonic acid CAS Name: sodium 1,1,2-trimethyl-7-benzo[e]indolesulfonic acid IUPAC Name: sodium 1,1,2-trimethylbenzo[e]indole-7-sulfonic acid Traditional Name: sodium 1,1,2-trimethylbenz[e]indole-7-sulfonic acid Formula: C15H15NNaO3S+ MolecularWeight: 312.33927

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C1(C)C)C3=C(C=C2)C=C(C=C3)S(=O)(=O)O.[Na+]

Isomeric SMILES

CC1=NC2=C(C1(C)C)C3=C(C=C2)C=C(C=C3)S(=O)(=O)O.[Na+]

InChI

InChI=1S/C15H15NO3S.Na/c1-9-15(2,3)14-12-6-5-11(20(17,18)19)8-10(12)4-7-13(14)16-9;/h4-8H,1-3H3,(H,17,18,19);/q;+1