2-methyl-2-[4-[[1-(naphthalen-2-ylmethyl)pyrazol-4-yl]methoxycarbonyl]phenoxy]propanoic acid

Systemtic Name: 2-methyl-2-[4-[[1-(naphthalen-2-ylmethyl)pyrazol-4-yl]methoxycarbonyl]phenoxy]propanoic acid Openeye Name: 2-methyl-2-[4-[[1-(2-naphthylmethyl)pyrazol-4-yl]methoxycarbonyl]phenoxy]propanoic acid CAS Name: 2-methyl-2-[4-[[1-(2-naphthalenylmethyl)-4-pyrazolyl]methoxy-oxomethyl]phenoxy]propanoic acid IUPAC Name: 2-methyl-2-[4-[[1-(naphthalen-2-ylmethyl)pyrazol-4-yl]methoxycarbonyl]phenoxy]propanoic acid Traditional Name: 2-methyl-2-[4-[[1-(2-naphthylmethyl)pyrazol-4-yl]methoxycarbonyl]phenoxy]propionic acid Formula: C26H24N2O5 MolecularWeight: 444.47916

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)O)OC1=CC=C(C=C1)C(=O)OCC2=CN(N=C2)CC3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CC(C)(C(=O)O)OC1=CC=C(C=C1)C(=O)OCC2=CN(N=C2)CC3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C26H24N2O5/c1-26(2,25(30)31)33-23-11-9-21(10-12-23)24(29)32-17-19-14-27-28(16-19)15-18-7-8-20-5-3-4-6-22(20)13-18/h3-14,16H,15,17H2,1-2H3,(H,30,31)