propyl 4-methylsulfonylbenzoate

Systemtic Name: propyl 4-methylsulfonylbenzoate Openeye Name: propyl 4-methylsulfonylbenzoate CAS Name: 4-methylsulfonylbenzoic acid propyl ester IUPAC Name: propyl 4-methylsulfonylbenzoate Traditional Name: 4-mesylbenzoic acid propyl ester Formula: C11H14O4S MolecularWeight: 242.29146

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)S(=O)(=O)C

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)S(=O)(=O)C

InChI

InChI=1S/C11H14O4S/c1-3-8-15-11(12)9-4-6-10(7-5-9)16(2,13)14/h4-7H,3,8H2,1-2H3