methyl 1-(3-methylsulfonylphenyl)carbonylpyrrolidine-2-carboxylate

Systemtic Name: methyl 1-(3-methylsulfonylphenyl)carbonylpyrrolidine-2-carboxylate Openeye Name: methyl 1-(3-methylsulfonylbenzoyl)pyrrolidine-2-carboxylate CAS Name: 1-[(3-methylsulfonylphenyl)-oxomethyl]-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl 1-(3-methylsulfonylbenzoyl)pyrrolidine-2-carboxylate Traditional Name: 1-(3-mesylbenzoyl)pyrrolidine-2-carboxylic acid methyl ester Formula: C14H17NO5S MolecularWeight: 311.35348

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCCN1C(=O)C2=CC(=CC=C2)S(=O)(=O)C

Isomeric SMILES

COC(=O)C1CCCN1C(=O)C2=CC(=CC=C2)S(=O)(=O)C

InChI

InChI=1S/C14H17NO5S/c1-20-14(17)12-7-4-8-15(12)13(16)10-5-3-6-11(9-10)21(2,18)19/h3,5-6,9,12H,4,7-8H2,1-2H3