3,4-dihydro-2H-pyrrole; 2-[4-(2-hydroxyethyl)piperazin-1-yl]ethanesulfonic acid

Systemtic Name: 3,4-dihydro-2H-pyrrole; 2-[4-(2-hydroxyethyl)piperazin-1-yl]ethanesulfonic acid Openeye Name: 3,4-dihydro-2H-pyrrole; 2-[4-(2-hydroxyethyl)piperazin-1-yl]ethanesulfonic acid CAS Name: 3,4-dihydro-2H-pyrrole; 2-[4-(2-hydroxyethyl)-1-piperazinyl]ethanesulfonic acid IUPAC Name: 3,4-dihydro-2H-pyrrole; 2-[4-(2-hydroxyethyl)piperazin-1-yl]ethanesulfonic acid Traditional Name: 2-[4-(2-hydroxyethyl)piperazino]ethanesulfonic acid; 1-pyrroline Formula: C12H25N3O4S MolecularWeight: 307.4096

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Descriptors Computed from Structure

Canonical SMILES:

C1CC=NC1.C1CN(CCN1CCO)CCS(=O)(=O)O

Isomeric SMILES

C1CC=NC1.C1CN(CCN1CCO)CCS(=O)(=O)O

InChI

InChI=1S/C8H18N2O4S.C4H7N/c11-7-5-9-1-3-10(4-2-9)6-8-15(12,13)14;1-2-4-5-3-1/h11H,1-8H2,(H,12,13,14);3H,1-2,4H2