2-methyl-6-[[3-[(2-phenyl-1,3-thiazol-4-yl)methoxy]phenoxy]methyl]benzoic acid

Systemtic Name: 2-methyl-6-[[3-[(2-phenyl-1,3-thiazol-4-yl)methoxy]phenoxy]methyl]benzoic acid Openeye Name: 2-methyl-6-[[3-[(2-phenylthiazol-4-yl)methoxy]phenoxy]methyl]benzoic acid CAS Name: 2-methyl-6-[[3-[(2-phenyl-4-thiazolyl)methoxy]phenoxy]methyl]benzoic acid IUPAC Name: 2-methyl-6-[[3-[(2-phenyl-1,3-thiazol-4-yl)methoxy]phenoxy]methyl]benzoic acid Traditional Name: 2-methyl-6-[[3-[(2-phenylthiazol-4-yl)methoxy]phenoxy]methyl]benzoic acid Formula: C25H21NO4S MolecularWeight: 431.50354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)COC2=CC(=CC=C2)OCC3=CSC(=N3)C4=CC=CC=C4)C(=O)O

Isomeric SMILES

CC1=C(C(=CC=C1)COC2=CC(=CC=C2)OCC3=CSC(=N3)C4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C25H21NO4S/c1-17-7-5-10-19(23(17)25(27)28)14-29-21-11-6-12-22(13-21)30-15-20-16-31-24(26-20)18-8-3-2-4-9-18/h2-13,16H,14-15H2,1H3,(H,27,28)