3-oxidanylidene-3-[[4-[4-oxidanyl-3-(2-oxidanylpropan-2-yl)phenoxy]phenyl]amino]propanoic acid

Systemtic Name: 3-oxidanylidene-3-[[4-[4-oxidanyl-3-(2-oxidanylpropan-2-yl)phenoxy]phenyl]amino]propanoic acid Openeye Name: 3-[4-[4-hydroxy-3-(1-hydroxy-1-methyl-ethyl)phenoxy]anilino]-3-oxo-propanoic acid CAS Name: 3-[4-[4-hydroxy-3-(2-hydroxypropan-2-yl)phenoxy]anilino]-3-oxopropanoic acid IUPAC Name: 3-[4-[4-hydroxy-3-(2-hydroxypropan-2-yl)phenoxy]anilino]-3-oxopropanoic acid Traditional Name: 3-[4-[4-hydroxy-3-(1-hydroxy-1-methyl-ethyl)phenoxy]anilino]-3-keto-propionic acid Formula: C18H19NO6 MolecularWeight: 345.34656

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=C(C=CC(=C1)OC2=CC=C(C=C2)NC(=O)CC(=O)O)O)O

Isomeric SMILES

CC(C)(C1=C(C=CC(=C1)OC2=CC=C(C=C2)NC(=O)CC(=O)O)O)O

InChI

InChI=1S/C18H19NO6/c1-18(2,24)14-9-13(7-8-15(14)20)25-12-5-3-11(4-6-12)19-16(21)10-17(22)23/h3-9,20,24H,10H2,1-2H3,(H,19,21)(H,22,23)