1-butylsulfonyl-2,3-dihydroindole-5-carboxylic acid

Systemtic Name: 1-butylsulfonyl-2,3-dihydroindole-5-carboxylic acid Openeye Name: 1-butylsulfonylindoline-5-carboxylic acid CAS Name: 1-butylsulfonyl-2,3-dihydroindole-5-carboxylic acid IUPAC Name: 1-butylsulfonyl-2,3-dihydroindole-5-carboxylic acid Traditional Name: 1-butylsulfonylindoline-5-carboxylic acid Formula: C13H17NO4S MolecularWeight: 283.34338

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)N1CCC2=C1C=CC(=C2)C(=O)O

Isomeric SMILES

CCCCS(=O)(=O)N1CCC2=C1C=CC(=C2)C(=O)O

InChI

InChI=1S/C13H17NO4S/c1-2-3-8-19(17,18)14-7-6-10-9-11(13(15)16)4-5-12(10)14/h4-5,9H,2-3,6-8H2,1H3,(H,15,16)