methyl 5-chloranyl-2-(1,3-dioxan-2-ylmethyl)benzoate

Systemtic Name: methyl 5-chloranyl-2-(1,3-dioxan-2-ylmethyl)benzoate Openeye Name: methyl 5-chloro-2-(1,3-dioxan-2-ylmethyl)benzoate CAS Name: 5-chloro-2-(1,3-dioxan-2-ylmethyl)benzoic acid methyl ester IUPAC Name: methyl 5-chloro-2-(1,3-dioxan-2-ylmethyl)benzoate Traditional Name: 5-chloro-2-(1,3-dioxan-2-ylmethyl)benzoic acid methyl ester Formula: C13H15ClO4 MolecularWeight: 270.7088

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1)Cl)CC2OCCCO2

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1)Cl)CC2OCCCO2

InChI

InChI=1S/C13H15ClO4/c1-16-13(15)11-8-10(14)4-3-9(11)7-12-17-5-2-6-18-12/h3-4,8,12H,2,5-7H2,1H3