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S-[5-(hydroxymethyl)pyrrolidin-3-yl] benzenecarbothioate

S-[5-(hydroxymethyl)pyrrolidin-3-yl] benzenecarbothioate

Systemtic Name:S-[5-(hydroxymethyl)pyrrolidin-3-yl] benzenecarbothioate
Openeye Name:S-[5-(hydroxymethyl)pyrrolidin-3-yl] benzenecarbothioate
CAS Name:benzenecarbothioic acid S-[5-(hydroxymethyl)-3-pyrrolidinyl] ester
IUPAC Name:S-[5-(hydroxymethyl)pyrrolidin-3-yl] benzenecarbothioate
Traditional Name:thiobenzoic acid S-(5-methylolpyrrolidin-3-yl) ester
Formula: C12H15NO2S
MolecularWeight: 237.318
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Descriptors Computed from Structure

Canonical SMILES:

C1C(CNC1CO)SC(=O)C2=CC=CC=C2


Isomeric SMILES

C1C(CNC1CO)SC(=O)C2=CC=CC=C2


InChI

InChI=1S/C12H15NO2S/c14-8-10-6-11(7-13-10)16-12(15)9-4-2-1-3-5-9/h1-5,10-11,13-14H,6-8H2


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