2-[4-[[4-(furan-2-ylcarbonylamino)phenyl]carbamoylamino]phenoxy]-2-methyl-propanoic acid

Systemtic Name: 2-[4-[[4-(furan-2-ylcarbonylamino)phenyl]carbamoylamino]phenoxy]-2-methyl-propanoic acid Openeye Name: 2-[4-[[4-(furan-2-carbonylamino)phenyl]carbamoylamino]phenoxy]-2-methyl-propanoic acid CAS Name: 2-[4-[[[4-[[2-furanyl(oxo)methyl]amino]anilino]-oxomethyl]amino]phenoxy]-2-methylpropanoic acid IUPAC Name: 2-[4-[[4-(furan-2-carbonylamino)phenyl]carbamoylamino]phenoxy]-2-methylpropanoic acid Traditional Name: 2-[4-[[4-(2-furoylamino)phenyl]carbamoylamino]phenoxy]-2-methyl-propionic acid Formula: C22H21N3O6 MolecularWeight: 423.41864

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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)NC(=O)C3=CC=CO3

Isomeric SMILES

CC(C)(C(=O)O)OC1=CC=C(C=C1)NC(=O)NC2=CC=C(C=C2)NC(=O)C3=CC=CO3

InChI

InChI=1S/C22H21N3O6/c1-22(2,20(27)28)31-17-11-9-16(10-12-17)25-21(29)24-15-7-5-14(6-8-15)23-19(26)18-4-3-13-30-18/h3-13H,1-2H3,(H,23,26)(H,27,28)(H2,24,25,29)