2-[4-[(4-chloranyl-3,5-dimethyl-phenoxy)methyl]phenyl]-4-methyl-1,3-thiazole-5-carboxylic acid

Systemtic Name: 2-[4-[(4-chloranyl-3,5-dimethyl-phenoxy)methyl]phenyl]-4-methyl-1,3-thiazole-5-carboxylic acid Openeye Name: 2-[4-[(4-chloro-3,5-dimethyl-phenoxy)methyl]phenyl]-4-methyl-thiazole-5-carboxylic acid CAS Name: 2-[4-[(4-chloro-3,5-dimethylphenoxy)methyl]phenyl]-4-methyl-5-thiazolecarboxylic acid IUPAC Name: 2-[4-[(4-chloro-3,5-dimethylphenoxy)methyl]phenyl]-4-methyl-1,3-thiazole-5-carboxylic acid Traditional Name: 2-[4-[(4-chloro-3,5-dimethyl-phenoxy)methyl]phenyl]-4-methyl-thiazole-5-carboxylic 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(=C(S3)C(=O)O)C

Isomeric SMILES

CC1=CC(=CC(=C1Cl)C)OCC2=CC=C(C=C2)C3=NC(=C(S3)C(=O)O)C

InChI

InChI=1S/C20H18ClNO3S/c1-11-8-16(9-12(2)17(11)21)25-10-14-4-6-15(7-5-14)19-22-13(3)18(26-19)20(23)24/h4-9H,10H2,1-3H3,(H,23,24)