pyridin-2-ylmethyl 2-methyl-5-methylsulfonyl-benzoate

Systemtic Name: pyridin-2-ylmethyl 2-methyl-5-methylsulfonyl-benzoate Openeye Name: 2-pyridylmethyl 2-methyl-5-methylsulfonyl-benzoate CAS Name: 2-methyl-5-methylsulfonylbenzoic acid 2-pyridinylmethyl ester IUPAC Name: pyridin-2-ylmethyl 2-methyl-5-methylsulfonylbenzoate Traditional Name: 5-mesyl-2-methyl-benzoic acid 2-pyridylmethyl ester Formula: C15H15NO4S MolecularWeight: 305.3489

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)C)C(=O)OCC2=CC=CC=N2

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)C)C(=O)OCC2=CC=CC=N2

InChI

InChI=1S/C15H15NO4S/c1-11-6-7-13(21(2,18)19)9-14(11)15(17)20-10-12-5-3-4-8-16-12/h3-9H,10H2,1-2H3