2-[[2-methyl-4-[2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethoxy]phenyl]methyl]propanedioic acid

Systemtic Name: 2-[[2-methyl-4-[2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethoxy]phenyl]methyl]propanedioic acid Openeye Name: 2-[[2-methyl-4-[2-(5-methyl-2-phenyl-oxazol-4-yl)ethoxy]phenyl]methyl]propanedioic acid CAS Name: 2-[[2-methyl-4-[2-(5-methyl-2-phenyl-4-oxazolyl)ethoxy]phenyl]methyl]propanedioic acid IUPAC Name: 2-[[2-methyl-4-[2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethoxy]phenyl]methyl]propanedioic acid Traditional Name: 2-[2-methyl-4-[2-(5-methyl-2-phenyl-oxazol-4-yl)ethoxy]benzyl]malonic acid Formula: C23H23NO6 MolecularWeight: 409.43182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCCC2=C(OC(=N2)C3=CC=CC=C3)C)CC(C(=O)O)C(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)OCCC2=C(OC(=N2)C3=CC=CC=C3)C)CC(C(=O)O)C(=O)O

InChI

InChI=1S/C23H23NO6/c1-14-12-18(9-8-17(14)13-19(22(25)26)23(27)28)29-11-10-20-15(2)30-21(24-20)16-6-4-3-5-7-16/h3-9,12,19H,10-11,13H2,1-2H3,(H,25,26)(H,27,28)