methyl 3-[(phenoxysulfonylamino)methyl]-1-(2-propan-2-ylsulfonylbutyl)indole-5-carboxylate

Systemtic Name: methyl 3-[(phenoxysulfonylamino)methyl]-1-(2-propan-2-ylsulfonylbutyl)indole-5-carboxylate Openeye Name: methyl 1-(2-isopropylsulfonylbutyl)-3-[(phenoxysulfonylamino)methyl]indole-5-carboxylate CAS Name: 3-[(phenoxysulfonylamino)methyl]-1-(2-propan-2-ylsulfonylbutyl)-5-indolecarboxylic acid methyl ester IUPAC Name: methyl 3-[(phenoxysulfonylamino)methyl]-1-(2-propan-2-ylsulfonylbutyl)indole-5-carboxylate Traditional Name: 1-(2-isopropylsulfonylbutyl)-3-[(phenoxysulfonylamino)methyl]indole-5-carboxylic acid methyl ester Formula: C24H30N2O7S2 MolecularWeight: 522.6342

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CN1C=C(C2=C1C=CC(=C2)C(=O)OC)CNS(=O)(=O)OC3=CC=CC=C3)S(=O)(=O)C(C)C

Isomeric SMILES

CCC(CN1C=C(C2=C1C=CC(=C2)C(=O)OC)CNS(=O)(=O)OC3=CC=CC=C3)S(=O)(=O)C(C)C

InChI

InChI=1S/C24H30N2O7S2/c1-5-21(34(28,29)17(2)3)16-26-15-19(22-13-18(24(27)32-4)11-12-23(22)26)14-25-35(30,31)33-20-9-7-6-8-10-20/h6-13,15,17,21,25H,5,14,16H2,1-4H3