methyl 3-(3-methylsulfonylphenyl)pyrrolidine-1-carboxylate

Systemtic Name: methyl 3-(3-methylsulfonylphenyl)pyrrolidine-1-carboxylate Openeye Name: methyl 3-(3-methylsulfonylphenyl)pyrrolidine-1-carboxylate CAS Name: 3-(3-methylsulfonylphenyl)-1-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl 3-(3-methylsulfonylphenyl)pyrrolidine-1-carboxylate Traditional Name: 3-(3-mesylphenyl)pyrrolidine-1-carboxylic acid methyl ester Formula: C13H17NO4S MolecularWeight: 283.34338

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)N1CCC(C1)C2=CC(=CC=C2)S(=O)(=O)C

Isomeric SMILES

COC(=O)N1CCC(C1)C2=CC(=CC=C2)S(=O)(=O)C

InChI

InChI=1S/C13H17NO4S/c1-18-13(15)14-7-6-11(9-14)10-4-3-5-12(8-10)19(2,16)17/h3-5,8,11H,6-7,9H2,1-2H3