2-[[4-(2-methylpropanoylamino)phenyl]sulfonylamino]ethanoic acid

Systemtic Name: 2-[[4-(2-methylpropanoylamino)phenyl]sulfonylamino]ethanoic acid Openeye Name: 2-[[4-(2-methylpropanoylamino)phenyl]sulfonylamino]acetic acid CAS Name: 2-[[4-[(2-methyl-1-oxopropyl)amino]phenyl]sulfonylamino]acetic acid IUPAC Name: 2-[[4-(2-methylpropanoylamino)phenyl]sulfonylamino]acetic acid Traditional Name: 2-[[4-(isobutyrylamino)phenyl]sulfonylamino]acetic acid Formula: C12H16N2O5S MolecularWeight: 300.33084

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC=C(C=C1)S(=O)(=O)NCC(=O)O

Isomeric SMILES

CC(C)C(=O)NC1=CC=C(C=C1)S(=O)(=O)NCC(=O)O

InChI

InChI=1S/C12H16N2O5S/c1-8(2)12(17)14-9-3-5-10(6-4-9)20(18,19)13-7-11(15)16/h3-6,8,13H,7H2,1-2H3,(H,14,17)(H,15,16)