phenyl 2-(2-thiophen-3-ylpyrrolidin-1-yl)ethanesulfonate

Systemtic Name: phenyl 2-(2-thiophen-3-ylpyrrolidin-1-yl)ethanesulfonate Openeye Name: phenyl 2-[2-(3-thienyl)pyrrolidin-1-yl]ethanesulfonate CAS Name: 2-[2-(3-thiophenyl)-1-pyrrolidinyl]ethanesulfonic acid phenyl ester IUPAC Name: phenyl 2-(2-thiophen-3-ylpyrrolidin-1-yl)ethanesulfonate Traditional Name: 2-[2-(3-thienyl)pyrrolidino]ethanesulfonic acid phenyl ester Formula: C16H19NO3S2 MolecularWeight: 337.45696

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)CCS(=O)(=O)OC2=CC=CC=C2)C3=CSC=C3

Isomeric SMILES

C1CC(N(C1)CCS(=O)(=O)OC2=CC=CC=C2)C3=CSC=C3

InChI

InChI=1S/C16H19NO3S2/c18-22(19,20-15-5-2-1-3-6-15)12-10-17-9-4-7-16(17)14-8-11-21-13-14/h1-3,5-6,8,11,13,16H,4,7,9-10,12H2