2-[2-[4-[(4-chloranyl-3,5-dimethyl-phenoxy)methyl]phenyl]-1,3-thiazol-4-yl]ethanoic acid

Systemtic Name: 2-[2-[4-[(4-chloranyl-3,5-dimethyl-phenoxy)methyl]phenyl]-1,3-thiazol-4-yl]ethanoic acid Openeye Name: 2-[2-[4-[(4-chloro-3,5-dimethyl-phenoxy)methyl]phenyl]thiazol-4-yl]acetic acid CAS Name: 2-[2-[4-[(4-chloro-3,5-dimethylphenoxy)methyl]phenyl]-4-thiazolyl]acetic acid IUPAC Name: 2-[2-[4-[(4-chloro-3,5-dimethylphenoxy)methyl]phenyl]-1,3-thiazol-4-yl]acetic acid Traditional Name: 2-[2-[4-[(4-chloro-3,5-dimethyl-phenoxy)methyl]phenyl]thiazol-4-yl]acetic acid Formula: C20H18ClNO3S MolecularWeight: 387.87982

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1Cl)C)OCC2=CC=C(C=C2)C3=NC(=CS3)CC(=O)O

Isomeric SMILES

CC1=CC(=CC(=C1Cl)C)OCC2=CC=C(C=C2)C3=NC(=CS3)CC(=O)O

InChI

InChI=1S/C20H18ClNO3S/c1-12-7-17(8-13(2)19(12)21)25-10-14-3-5-15(6-4-14)20-22-16(11-26-20)9-18(23)24/h3-8,11H,9-10H2,1-2H3,(H,23,24)