2-[5-methyl-2-(oxan-2-yloxymethyl)-3-(1,3-thiazol-4-yl)phenyl]-3-oxidanylidene-propanoic acid

Systemtic Name: 2-[5-methyl-2-(oxan-2-yloxymethyl)-3-(1,3-thiazol-4-yl)phenyl]-3-oxidanylidene-propanoic acid Openeye Name: 2-[5-methyl-2-(tetrahydropyran-2-yloxymethyl)-3-thiazol-4-yl-phenyl]-3-oxo-propanoic acid CAS Name: 2-[5-methyl-2-(2-oxanyloxymethyl)-3-(4-thiazolyl)phenyl]-3-oxopropanoic acid IUPAC Name: 2-[5-methyl-2-(oxan-2-yloxymethyl)-3-(1,3-thiazol-4-yl)phenyl]-3-oxopropanoic acid Traditional Name: 3-keto-2-[5-methyl-2-(tetrahydropyran-2-yloxymethyl)-3-thiazol-4-yl-phenyl]propionic acid Formula: C19H21NO5S MolecularWeight: 375.43874

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C2=CSC=N2)COC3CCCCO3)C(C=O)C(=O)O

Isomeric SMILES

CC1=CC(=C(C(=C1)C2=CSC=N2)COC3CCCCO3)C(C=O)C(=O)O

InChI

InChI=1S/C19H21NO5S/c1-12-6-13(15(8-21)19(22)23)16(9-25-18-4-2-3-5-24-18)14(7-12)17-10-26-11-20-17/h6-8,10-11,15,18H,2-5,9H2,1H3,(H,22,23)