4-(3-methylphenyl)oxane-4-carboxylic acid

Systemtic Name: 4-(3-methylphenyl)oxane-4-carboxylic acid Openeye Name: 4-(m-tolyl)tetrahydropyran-4-carboxylic acid CAS Name: 4-(3-methylphenyl)-4-oxanecarboxylic acid IUPAC Name: 4-(3-methylphenyl)oxane-4-carboxylic acid Traditional Name: 4-(m-tolyl)tetrahydropyran-4-carboxylic acid Formula: C13H16O3 MolecularWeight: 220.26434

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2(CCOCC2)C(=O)O

Isomeric SMILES

CC1=CC=CC(=C1)C2(CCOCC2)C(=O)O

InChI

InChI=1S/C13H16O3/c1-10-3-2-4-11(9-10)13(12(14)15)5-7-16-8-6-13/h2-4,9H,5-8H2,1H3,(H,14,15)