methyl 2-(2-methylsulfonylphenyl)carbonylpyrazolidine-1-carboxylate

Systemtic Name: methyl 2-(2-methylsulfonylphenyl)carbonylpyrazolidine-1-carboxylate Openeye Name: methyl 2-(2-methylsulfonylbenzoyl)pyrazolidine-1-carboxylate CAS Name: 2-[(2-methylsulfonylphenyl)-oxomethyl]-1-pyrazolidinecarboxylic acid methyl ester IUPAC Name: methyl 2-(2-methylsulfonylbenzoyl)pyrazolidine-1-carboxylate Traditional Name: 2-(2-mesylbenzoyl)pyrazolidine-1-carboxylic acid methyl ester Formula: C13H16N2O5S MolecularWeight: 312.34154

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)N1CCCN1C(=O)C2=CC=CC=C2S(=O)(=O)C

Isomeric SMILES

COC(=O)N1CCCN1C(=O)C2=CC=CC=C2S(=O)(=O)C

InChI

InChI=1S/C13H16N2O5S/c1-20-13(17)15-9-5-8-14(15)12(16)10-6-3-4-7-11(10)21(2,18)19/h3-4,6-7H,5,8-9H2,1-2H3