4-[[4-(2,3-dihydro-1H-inden-5-ylamino)-4-oxidanylidene-butyl]sulfamoyl]benzoate

Systemtic Name: 4-[[4-(2,3-dihydro-1H-inden-5-ylamino)-4-oxidanylidene-butyl]sulfamoyl]benzoate Openeye Name: 4-[[4-(indan-5-ylamino)-4-oxo-butyl]sulfamoyl]benzoate CAS Name: 4-[[4-(2,3-dihydro-1H-inden-5-ylamino)-4-oxobutyl]sulfamoyl]benzoate IUPAC Name: 4-[[4-(2,3-dihydro-1H-inden-5-ylamino)-4-oxobutyl]sulfamoyl]benzoate Traditional Name: 4-[[4-(indan-5-ylamino)-4-keto-butyl]sulfamoyl]benzoate Formula: C20H21N2O5S- MolecularWeight: 401.45614

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)NC(=O)CCCNS(=O)(=O)C3=CC=C(C=C3)C(=O)[O-]

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)NC(=O)CCCNS(=O)(=O)C3=CC=C(C=C3)C(=O)[O-]

InChI

InChI=1S/C20H22N2O5S/c23-19(22-17-9-6-14-3-1-4-16(14)13-17)5-2-12-21-28(26,27)18-10-7-15(8-11-18)20(24)25/h6-11,13,21H,1-5,12H2,(H,22,23)(H,24,25)/p-1