ethyl 2-phenylsulfanylpyrrolidine-1-carboxylate

Systemtic Name: ethyl 2-phenylsulfanylpyrrolidine-1-carboxylate Openeye Name: ethyl 2-phenylsulfanylpyrrolidine-1-carboxylate CAS Name: 2-(phenylthio)-1-pyrrolidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-phenylsulfanylpyrrolidine-1-carboxylate Traditional Name: 2-(phenylthio)pyrrolidine-1-carboxylic acid ethyl ester Formula: C13H17NO2S MolecularWeight: 251.34458

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCCC1SC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)N1CCCC1SC2=CC=CC=C2

InChI

InChI=1S/C13H17NO2S/c1-2-16-13(15)14-10-6-9-12(14)17-11-7-4-3-5-8-11/h3-5,7-8,12H,2,6,9-10H2,1H3