1-ethylsulfonyl-5-(ethylsulfonylamino)-2,6-dimethyl-indole-3-carboxylic acid

Systemtic Name: 1-ethylsulfonyl-5-(ethylsulfonylamino)-2,6-dimethyl-indole-3-carboxylic acid Openeye Name: 1-ethylsulfonyl-5-(ethylsulfonylamino)-2,6-dimethyl-indole-3-carboxylic acid CAS Name: 1-ethylsulfonyl-5-(ethylsulfonylamino)-2,6-dimethyl-3-indolecarboxylic acid IUPAC Name: 1-ethylsulfonyl-5-(ethylsulfonylamino)-2,6-dimethylindole-3-carboxylic acid Traditional Name: 1-esyl-5-(esylamino)-2,6-dimethyl-indole-3-carboxylic acid Formula: C15H20N2O6S2 MolecularWeight: 388.4591

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)NC1=C(C=C2C(=C1)C(=C(N2S(=O)(=O)CC)C)C(=O)O)C

Isomeric SMILES

CCS(=O)(=O)NC1=C(C=C2C(=C1)C(=C(N2S(=O)(=O)CC)C)C(=O)O)C

InChI

InChI=1S/C15H20N2O6S2/c1-5-24(20,21)16-12-8-11-13(7-9(12)3)17(25(22,23)6-2)10(4)14(11)15(18)19/h7-8,16H,5-6H2,1-4H3,(H,18,19)