2-methyl-5-[4-[5-methyl-2-(3-methylphenyl)-1,3-oxazol-4-yl]butyl]-1,3-dioxane-2-carboxylic acid

Systemtic Name: 2-methyl-5-[4-[5-methyl-2-(3-methylphenyl)-1,3-oxazol-4-yl]butyl]-1,3-dioxane-2-carboxylic acid Openeye Name: 2-methyl-5-[4-[5-methyl-2-(m-tolyl)oxazol-4-yl]butyl]-1,3-dioxane-2-carboxylic acid CAS Name: 2-methyl-5-[4-[5-methyl-2-(3-methylphenyl)-4-oxazolyl]butyl]-1,3-dioxane-2-carboxylic acid IUPAC Name: 2-methyl-5-[4-[5-methyl-2-(3-methylphenyl)-1,3-oxazol-4-yl]butyl]-1,3-dioxane-2-carboxylic acid Traditional Name: 2-methyl-5-[4-[5-methyl-2-(m-tolyl)oxazol-4-yl]butyl]-1,3-dioxane-2-carboxylic acid Formula: C21H27NO5 MolecularWeight: 373.44278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NC(=C(O2)C)CCCCC3COC(OC3)(C)C(=O)O

Isomeric SMILES

CC1=CC=CC(=C1)C2=NC(=C(O2)C)CCCCC3COC(OC3)(C)C(=O)O

InChI

InChI=1S/C21H27NO5/c1-14-7-6-9-17(11-14)19-22-18(15(2)27-19)10-5-4-8-16-12-25-21(3,20(23)24)26-13-16/h6-7,9,11,16H,4-5,8,10,12-13H2,1-3H3,(H,23,24)