4-(2-ethylhexoxymethyl)-1,3-thiazole-2-carboxylic acid

Systemtic Name: 4-(2-ethylhexoxymethyl)-1,3-thiazole-2-carboxylic acid Openeye Name: 4-(2-ethylhexoxymethyl)thiazole-2-carboxylic acid CAS Name: 4-(2-ethylhexoxymethyl)-2-thiazolecarboxylic acid IUPAC Name: 4-(2-ethylhexoxymethyl)-1,3-thiazole-2-carboxylic acid Traditional Name: 4-(2-ethylhexoxymethyl)thiazole-2-carboxylic acid Formula: C13H21NO3S MolecularWeight: 271.37574

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)COCC1=CSC(=N1)C(=O)O

Isomeric SMILES

CCCCC(CC)COCC1=CSC(=N1)C(=O)O

InChI

InChI=1S/C13H21NO3S/c1-3-5-6-10(4-2)7-17-8-11-9-18-12(14-11)13(15)16/h9-10H,3-8H2,1-2H3,(H,15,16)