2-[4-(3,4-dimethoxyphenyl)oxan-4-yl]-4-methyl-1,3-thiazole-5-carboxylic acid

Systemtic Name: 2-[4-(3,4-dimethoxyphenyl)oxan-4-yl]-4-methyl-1,3-thiazole-5-carboxylic acid Openeye Name: 2-[4-(3,4-dimethoxyphenyl)tetrahydropyran-4-yl]-4-methyl-thiazole-5-carboxylic acid CAS Name: 2-[4-(3,4-dimethoxyphenyl)-4-oxanyl]-4-methyl-5-thiazolecarboxylic acid IUPAC Name: 2-[4-(3,4-dimethoxyphenyl)oxan-4-yl]-4-methyl-1,3-thiazole-5-carboxylic acid Traditional Name: 2-[4-(3,4-dimethoxyphenyl)tetrahydropyran-4-yl]-4-methyl-thiazole-5-carboxylic acid Formula: C18H21NO5S MolecularWeight: 363.42804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C2(CCOCC2)C3=CC(=C(C=C3)OC)OC)C(=O)O

Isomeric SMILES

CC1=C(SC(=N1)C2(CCOCC2)C3=CC(=C(C=C3)OC)OC)C(=O)O

InChI

InChI=1S/C18H21NO5S/c1-11-15(16(20)21)25-17(19-11)18(6-8-24-9-7-18)12-4-5-13(22-2)14(10-12)23-3/h4-5,10H,6-9H2,1-3H3,(H,20,21)