[(2S)-2-[2,4-bis(oxidanyl)phenyl]-2-pyrrolidin-1-ium-1-yl-ethyl]azanium

Systemtic Name: [(2S)-2-[2,4-bis(oxidanyl)phenyl]-2-pyrrolidin-1-ium-1-yl-ethyl]azanium Openeye Name: [(2S)-2-(2,4-dihydroxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]ammonium CAS Name: [(2S)-2-(2,4-dihydroxyphenyl)-2-(1-pyrrolidin-1-iumyl)ethyl]ammonium IUPAC Name: [(2S)-2-(2,4-dihydroxyphenyl)-2-pyrrolidin-1-ium-1-ylethyl]azanium Traditional Name: [(2S)-2-(2,4-dihydroxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]ammonium Formula: C12H20N2O2+2 MolecularWeight: 224.2994

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)C(C[NH3+])C2=C(C=C(C=C2)O)O

Isomeric SMILES

C1CC[NH+](C1)[C@H](C[NH3+])C2=C(C=C(C=C2)O)O

InChI

InChI=1S/C12H18N2O2/c13-8-11(14-5-1-2-6-14)10-4-3-9(15)7-12(10)16/h3-4,7,11,15-16H,1-2,5-6,8,13H2/p+2/t11-/m1/s1