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

Systemtic Name: 2-[[4-(1,3-benzodioxol-5-yl)phenoxy]methyl]-1,3-thiazole-4-carboxylic acid Openeye Name: 2-[[4-(1,3-benzodioxol-5-yl)phenoxy]methyl]thiazole-4-carboxylic acid CAS Name: 2-[[4-(1,3-benzodioxol-5-yl)phenoxy]methyl]-4-thiazolecarboxylic acid IUPAC Name: 2-[[4-(1,3-benzodioxol-5-yl)phenoxy]methyl]-1,3-thiazole-4-carboxylic acid Traditional Name: 2-[[4-(1,3-benzodioxol-5-yl)phenoxy]methyl]thiazole-4-carboxylic acid Formula: C18H13NO5S MolecularWeight: 355.36452

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=CC=C(C=C3)OCC4=NC(=CS4)C(=O)O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=CC=C(C=C3)OCC4=NC(=CS4)C(=O)O

InChI

InChI=1S/C18H13NO5S/c20-18(21)14-9-25-17(19-14)8-22-13-4-1-11(2-5-13)12-3-6-15-16(7-12)24-10-23-15/h1-7,9H,8,10H2,(H,20,21)