(E)-3-[4-[(2-tert-butyl-1,3-benzoxazol-5-yl)sulfamoyl]phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[4-[(2-tert-butyl-1,3-benzoxazol-5-yl)sulfamoyl]phenyl]prop-2-enoic acid Openeye Name: (E)-3-[4-[(2-tert-butyl-1,3-benzoxazol-5-yl)sulfamoyl]phenyl]prop-2-enoic acid CAS Name: (E)-3-[4-[(2-tert-butyl-1,3-benzoxazol-5-yl)sulfamoyl]phenyl]-2-propenoic acid IUPAC Name: (E)-3-[4-[(2-tert-butyl-1,3-benzoxazol-5-yl)sulfamoyl]phenyl]prop-2-enoic acid Traditional Name: (E)-3-[4-[(2-tert-butyl-1,3-benzoxazol-5-yl)sulfamoyl]phenyl]acrylic acid Formula: C20H20N2O5S MolecularWeight: 400.4482

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC2=C(O1)C=CC(=C2)NS(=O)(=O)C3=CC=C(C=C3)C=CC(=O)O

Isomeric SMILES

CC(C)(C)C1=NC2=C(O1)C=CC(=C2)NS(=O)(=O)C3=CC=C(C=C3)/C=C/C(=O)O

InChI

InChI=1S/C20H20N2O5S/c1-20(2,3)19-21-16-12-14(7-10-17(16)27-19)22-28(25,26)15-8-4-13(5-9-15)6-11-18(23)24/h4-12,22H,1-3H3,(H,23,24)/b11-6+