2-[[4-(4-butoxyphenyl)phenyl]sulfonyl-propan-2-yloxy-amino]ethanoic acid

Systemtic Name: 2-[[4-(4-butoxyphenyl)phenyl]sulfonyl-propan-2-yloxy-amino]ethanoic acid Openeye Name: 2-[[4-(4-butoxyphenyl)phenyl]sulfonyl-isopropoxy-amino]acetic acid CAS Name: 2-[[4-(4-butoxyphenyl)phenyl]sulfonyl-propan-2-yloxyamino]acetic acid IUPAC Name: 2-[[4-(4-butoxyphenyl)phenyl]sulfonyl-propan-2-yloxyamino]acetic acid Traditional Name: 2-[[4-(4-butoxyphenyl)phenyl]sulfonyl-isopropoxy-amino]acetic acid Formula: C21H27NO6S MolecularWeight: 421.50718

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)S(=O)(=O)N(CC(=O)O)OC(C)C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)S(=O)(=O)N(CC(=O)O)OC(C)C

InChI

InChI=1S/C21H27NO6S/c1-4-5-14-27-19-10-6-17(7-11-19)18-8-12-20(13-9-18)29(25,26)22(15-21(23)24)28-16(2)3/h6-13,16H,4-5,14-15H2,1-3H3,(H,23,24)