4-(3,5-dimethylphenyl)oxane-4-carboxylate

Systemtic Name: 4-(3,5-dimethylphenyl)oxane-4-carboxylate Openeye Name: 4-(3,5-dimethylphenyl)tetrahydropyran-4-carboxylate CAS Name: 4-(3,5-dimethylphenyl)-4-oxanecarboxylate IUPAC Name: 4-(3,5-dimethylphenyl)oxane-4-carboxylate Traditional Name: 4-(3,5-dimethylphenyl)tetrahydropyran-4-carboxylate Formula: C14H17O3- MolecularWeight: 233.28298

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C2(CCOCC2)C(=O)[O-])C

Isomeric SMILES

CC1=CC(=CC(=C1)C2(CCOCC2)C(=O)[O-])C

InChI

InChI=1S/C14H18O3/c1-10-7-11(2)9-12(8-10)14(13(15)16)3-5-17-6-4-14/h7-9H,3-6H2,1-2H3,(H,15,16)/p-1