phenyl 2-pyrrolidin-1-ium-1-ylethanesulfonate

Systemtic Name: phenyl 2-pyrrolidin-1-ium-1-ylethanesulfonate Openeye Name: phenyl 2-pyrrolidin-1-ium-1-ylethanesulfonate CAS Name: 2-(1-pyrrolidin-1-iumyl)ethanesulfonic acid phenyl ester IUPAC Name: phenyl 2-pyrrolidin-1-ium-1-ylethanesulfonate Traditional Name: 2-pyrrolidin-1-ium-1-ylethanesulfonic acid phenyl ester Formula: C12H18NO3S+ MolecularWeight: 256.34122

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CCS(=O)(=O)OC2=CC=CC=C2

Isomeric SMILES

C1CC[NH+](C1)CCS(=O)(=O)OC2=CC=CC=C2

InChI

InChI=1S/C12H17NO3S/c14-17(15,11-10-13-8-4-5-9-13)16-12-6-2-1-3-7-12/h1-3,6-7H,4-5,8-11H2/p+1