but-3-enyl 2-(2-methylsulfonylphenyl)carbonylpyrazolidine-1-carboxylate

Systemtic Name: but-3-enyl 2-(2-methylsulfonylphenyl)carbonylpyrazolidine-1-carboxylate Openeye Name: but-3-enyl 2-(2-methylsulfonylbenzoyl)pyrazolidine-1-carboxylate CAS Name: 2-[(2-methylsulfonylphenyl)-oxomethyl]-1-pyrazolidinecarboxylic acid but-3-enyl ester IUPAC Name: but-3-enyl 2-(2-methylsulfonylbenzoyl)pyrazolidine-1-carboxylate Traditional Name: 2-(2-mesylbenzoyl)pyrazolidine-1-carboxylic acid but-3-enyl ester Formula: C16H20N2O5S MolecularWeight: 352.4054

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC=C1C(=O)N2CCCN2C(=O)OCCC=C

Isomeric SMILES

CS(=O)(=O)C1=CC=CC=C1C(=O)N2CCCN2C(=O)OCCC=C

InChI

InChI=1S/C16H20N2O5S/c1-3-4-12-23-16(20)18-11-7-10-17(18)15(19)13-8-5-6-9-14(13)24(2,21)22/h3,5-6,8-9H,1,4,7,10-12H2,2H3