2-[[3-[[4-(2,2-dimethylpropanoyloxy)-3-methyl-phenyl]sulfonylamino]phenyl]carbonylamino]ethanoic acid

Systemtic Name: 2-[[3-[[4-(2,2-dimethylpropanoyloxy)-3-methyl-phenyl]sulfonylamino]phenyl]carbonylamino]ethanoic acid Openeye Name: 2-[[3-[[4-(2,2-dimethylpropanoyloxy)-3-methyl-phenyl]sulfonylamino]benzoyl]amino]acetic acid CAS Name: 2-[[[3-[[4-(2,2-dimethyl-1-oxopropoxy)-3-methylphenyl]sulfonylamino]phenyl]-oxomethyl]amino]acetic acid IUPAC Name: 2-[[3-[[4-(2,2-dimethylpropanoyloxy)-3-methylphenyl]sulfonylamino]benzoyl]amino]acetic acid Traditional Name: 2-[[3-[(3-methyl-4-pivaloyloxy-phenyl)sulfonylamino]benzoyl]amino]acetic acid Formula: C21H24N2O7S MolecularWeight: 448.48946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)NC2=CC=CC(=C2)C(=O)NCC(=O)O)OC(=O)C(C)(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)NC2=CC=CC(=C2)C(=O)NCC(=O)O)OC(=O)C(C)(C)C

InChI

InChI=1S/C21H24N2O7S/c1-13-10-16(8-9-17(13)30-20(27)21(2,3)4)31(28,29)23-15-7-5-6-14(11-15)19(26)22-12-18(24)25/h5-11,23H,12H2,1-4H3,(H,22,26)(H,24,25)