octyl 1-ethylsulfonyl-5-(ethylsulfonylamino)-2-methyl-indole-3-carboxylate

Systemtic Name: octyl 1-ethylsulfonyl-5-(ethylsulfonylamino)-2-methyl-indole-3-carboxylate Openeye Name: octyl 1-ethylsulfonyl-5-(ethylsulfonylamino)-2-methyl-indole-3-carboxylate CAS Name: 1-ethylsulfonyl-5-(ethylsulfonylamino)-2-methyl-3-indolecarboxylic acid octyl ester IUPAC Name: octyl 1-ethylsulfonyl-5-(ethylsulfonylamino)-2-methylindole-3-carboxylate Traditional Name: 1-esyl-5-(esylamino)-2-methyl-indole-3-carboxylic acid octyl ester Formula: C22H34N2O6S2 MolecularWeight: 486.64516

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)C1=C(N(C2=C1C=C(C=C2)NS(=O)(=O)CC)S(=O)(=O)CC)C

Isomeric SMILES

CCCCCCCCOC(=O)C1=C(N(C2=C1C=C(C=C2)NS(=O)(=O)CC)S(=O)(=O)CC)C

InChI

InChI=1S/C22H34N2O6S2/c1-5-8-9-10-11-12-15-30-22(25)21-17(4)24(32(28,29)7-3)20-14-13-18(16-19(20)21)23-31(26,27)6-2/h13-14,16,23H,5-12,15H2,1-4H3