dipotassium 3,3-dimethyl-2-methylidene-1-(2-sulfonatoethyl)indole-5-sulfonate

Systemtic Name: dipotassium 3,3-dimethyl-2-methylidene-1-(2-sulfonatoethyl)indole-5-sulfonate Openeye Name: dipotassium 3,3-dimethyl-2-methylene-1-(2-sulfonatoethyl)indoline-5-sulfonate CAS Name: dipotassium 3,3-dimethyl-2-methylene-1-(2-sulfonatoethyl)-5-indolesulfonate IUPAC Name: dipotassium 3,3-dimethyl-2-methylidene-1-(2-sulfonatoethyl)indole-5-sulfonate Traditional Name: dipotassium 3,3-dimethyl-2-methylene-1-(2-sulfonatoethyl)indoline-5-sulfonate Formula: C13H15K2NO6S2 MolecularWeight: 423.5879

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=C)N(C2=C1C=C(C=C2)S(=O)(=O)[O-])CCS(=O)(=O)[O-])C.[K+].[K+]

Isomeric SMILES

CC1(C(=C)N(C2=C1C=C(C=C2)S(=O)(=O)[O-])CCS(=O)(=O)[O-])C.[K+].[K+]

InChI

InChI=1S/C13H17NO6S2.2K/c1-9-13(2,3)11-8-10(22(18,19)20)4-5-12(11)14(9)6-7-21(15,16)17;;/h4-5,8H,1,6-7H2,2-3H3,(H,15,16,17)(H,18,19,20);;/q;2*+1/p-2