4-[[4-(2-methyl-1-oxidanyl-1-oxidanylidene-propan-2-yl)oxyphenyl]carbamoylamino]benzoic acid

Systemtic Name: 4-[[4-(2-methyl-1-oxidanyl-1-oxidanylidene-propan-2-yl)oxyphenyl]carbamoylamino]benzoic acid Openeye Name: 4-[[4-(2-hydroxy-1,1-dimethyl-2-oxo-ethoxy)phenyl]carbamoylamino]benzoic acid CAS Name: 4-[[[4-(1-hydroxy-2-methyl-1-oxopropan-2-yl)oxyanilino]-oxomethyl]amino]benzoic acid IUPAC Name: 4-[[4-(1-hydroxy-2-methyl-1-oxopropan-2-yl)oxyphenyl]carbamoylamino]benzoic acid Traditional Name: 4-[[4-(2-hydroxy-2-keto-1,1-dimethyl-ethoxy)phenyl]carbamoylamino]benzoic acid Formula: C18H18N2O6 MolecularWeight: 358.34532

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)O)OC1=CC=C(C=C1)NC(=O)NC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CC(C)(C(=O)O)OC1=CC=C(C=C1)NC(=O)NC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C18H18N2O6/c1-18(2,16(23)24)26-14-9-7-13(8-10-14)20-17(25)19-12-5-3-11(4-6-12)15(21)22/h3-10H,1-2H3,(H,21,22)(H,23,24)(H2,19,20,25)