methyl 2-(1,3-dioxan-2-ylmethyl)-4-methyl-benzoate

Systemtic Name: methyl 2-(1,3-dioxan-2-ylmethyl)-4-methyl-benzoate Openeye Name: methyl 2-(1,3-dioxan-2-ylmethyl)-4-methyl-benzoate CAS Name: 2-(1,3-dioxan-2-ylmethyl)-4-methylbenzoic acid methyl ester IUPAC Name: methyl 2-(1,3-dioxan-2-ylmethyl)-4-methylbenzoate Traditional Name: 2-(1,3-dioxan-2-ylmethyl)-4-methyl-benzoic acid methyl ester Formula: C14H18O4 MolecularWeight: 250.29032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)OC)CC2OCCCO2

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)OC)CC2OCCCO2

InChI

InChI=1S/C14H18O4/c1-10-4-5-12(14(15)16-2)11(8-10)9-13-17-6-3-7-18-13/h4-5,8,13H,3,6-7,9H2,1-2H3