[(3S)-1-(phenylmethyl)pyrrolidin-3-yl] benzenesulfonate

Systemtic Name: [(3S)-1-(phenylmethyl)pyrrolidin-3-yl] benzenesulfonate Openeye Name: [(3S)-1-benzylpyrrolidin-3-yl] benzenesulfonate CAS Name: benzenesulfonic acid [(3S)-1-(phenylmethyl)-3-pyrrolidinyl] ester IUPAC Name: [(3S)-1-benzylpyrrolidin-3-yl] benzenesulfonate Traditional Name: benzenesulfonic acid [(3S)-1-benzylpyrrolidin-3-yl] ester Formula: C17H19NO3S MolecularWeight: 317.40266

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1OS(=O)(=O)C2=CC=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

C1CN(C[C@H]1OS(=O)(=O)C2=CC=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C17H19NO3S/c19-22(20,17-9-5-2-6-10-17)21-16-11-12-18(14-16)13-15-7-3-1-4-8-15/h1-10,16H,11-14H2/t16-/m0/s1