4-(2-methylphenyl)oxane-4-carboxylate

Systemtic Name: 4-(2-methylphenyl)oxane-4-carboxylate Openeye Name: 4-(o-tolyl)tetrahydropyran-4-carboxylate CAS Name: 4-(2-methylphenyl)-4-oxanecarboxylate IUPAC Name: 4-(2-methylphenyl)oxane-4-carboxylate Traditional Name: 4-(o-tolyl)tetrahydropyran-4-carboxylate Formula: C13H15O3- MolecularWeight: 219.2564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2(CCOCC2)C(=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1C2(CCOCC2)C(=O)[O-]

InChI

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