3-[(4-butoxyphenyl)sulfonylamino]-2-(2,3-dihydro-1H-inden-5-yl)propanoic acid

Systemtic Name: 3-[(4-butoxyphenyl)sulfonylamino]-2-(2,3-dihydro-1H-inden-5-yl)propanoic acid Openeye Name: 3-[(4-butoxyphenyl)sulfonylamino]-2-indan-5-yl-propanoic acid CAS Name: 3-[(4-butoxyphenyl)sulfonylamino]-2-(2,3-dihydro-1H-inden-5-yl)propanoic acid IUPAC Name: 3-[(4-butoxyphenyl)sulfonylamino]-2-(2,3-dihydro-1H-inden-5-yl)propanoic acid Traditional Name: 3-[(4-butoxyphenyl)sulfonylamino]-2-indan-5-yl-propionic acid Formula: C22H27NO5S MolecularWeight: 417.51848

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)S(=O)(=O)NCC(C2=CC3=C(CCC3)C=C2)C(=O)O

Isomeric SMILES

CCCCOC1=CC=C(C=C1)S(=O)(=O)NCC(C2=CC3=C(CCC3)C=C2)C(=O)O

InChI

InChI=1S/C22H27NO5S/c1-2-3-13-28-19-9-11-20(12-10-19)29(26,27)23-15-21(22(24)25)18-8-7-16-5-4-6-17(16)14-18/h7-12,14,21,23H,2-6,13,15H2,1H3,(H,24,25)