2-[4-methoxy-3-[4-(1-methylpyrazol-4-yl)-2-(propan-2-ylsulfonylmethyl)phenoxy]phenyl]ethanoic acid

Systemtic Name: 2-[4-methoxy-3-[4-(1-methylpyrazol-4-yl)-2-(propan-2-ylsulfonylmethyl)phenoxy]phenyl]ethanoic acid Openeye Name: 2-[3-[2-(isopropylsulfonylmethyl)-4-(1-methylpyrazol-4-yl)phenoxy]-4-methoxy-phenyl]acetic acid CAS Name: 2-[4-methoxy-3-[4-(1-methyl-4-pyrazolyl)-2-(propan-2-ylsulfonylmethyl)phenoxy]phenyl]acetic acid IUPAC Name: 2-[4-methoxy-3-[4-(1-methylpyrazol-4-yl)-2-(propan-2-ylsulfonylmethyl)phenoxy]phenyl]acetic acid Traditional Name: 2-[3-[2-(isopropylsulfonylmethyl)-4-(1-methylpyrazol-4-yl)phenoxy]-4-methoxy-phenyl]acetic acid Formula: C23H26N2O6S MolecularWeight: 458.52734

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)CC1=C(C=CC(=C1)C2=CN(N=C2)C)OC3=C(C=CC(=C3)CC(=O)O)OC

Isomeric SMILES

CC(C)S(=O)(=O)CC1=C(C=CC(=C1)C2=CN(N=C2)C)OC3=C(C=CC(=C3)CC(=O)O)OC

InChI

InChI=1S/C23H26N2O6S/c1-15(2)32(28,29)14-18-11-17(19-12-24-25(3)13-19)6-8-20(18)31-22-9-16(10-23(26)27)5-7-21(22)30-4/h5-9,11-13,15H,10,14H2,1-4H3,(H,26,27)