3-[(2-propan-2-yl-1,3-benzoxazol-5-yl)sulfamoyl]propanoic acid

Systemtic Name: 3-[(2-propan-2-yl-1,3-benzoxazol-5-yl)sulfamoyl]propanoic acid Openeye Name: 3-[(2-isopropyl-1,3-benzoxazol-5-yl)sulfamoyl]propanoic acid CAS Name: 3-[(2-propan-2-yl-1,3-benzoxazol-5-yl)sulfamoyl]propanoic acid IUPAC Name: 3-[(2-propan-2-yl-1,3-benzoxazol-5-yl)sulfamoyl]propanoic acid Traditional Name: 3-[(2-isopropyl-1,3-benzoxazol-5-yl)sulfamoyl]propionic acid Formula: C13H16N2O5S MolecularWeight: 312.34154

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16N2O5S/c1-8(2)13-14-10-7-9(3-4-11(10)20-13)15-21(18,19)6-5-12(16)17/h3-4,7-8,15H,5-6H2,1-2H3,(H,16,17)