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(2S)-2-[(2-nitrophenyl)methyl]pyrrolidin-1-ium-2-carboxylate

(2S)-2-[(2-nitrophenyl)methyl]pyrrolidin-1-ium-2-carboxylate

Systemtic Name:(2S)-2-[(2-nitrophenyl)methyl]pyrrolidin-1-ium-2-carboxylate
Openeye Name:(2S)-2-[(2-nitrophenyl)methyl]pyrrolidin-1-ium-2-carboxylate
CAS Name:(2S)-2-[(2-nitrophenyl)methyl]-2-pyrrolidin-1-iumcarboxylate
IUPAC Name:(2S)-2-[(2-nitrophenyl)methyl]pyrrolidin-1-ium-2-carboxylate
Traditional Name:(2S)-2-(2-nitrobenzyl)pyrrolidin-1-ium-2-carboxylate
Formula: C12H14N2O4
MolecularWeight: 250.25056
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Descriptors Computed from Structure

Canonical SMILES:

C1CC([NH2+]C1)(CC2=CC=CC=C2[N+](=O)[O-])C(=O)[O-]


Isomeric SMILES

C1C[C@]([NH2+]C1)(CC2=CC=CC=C2[N+](=O)[O-])C(=O)[O-]


InChI

InChI=1S/C12H14N2O4/c15-11(16)12(6-3-7-13-12)8-9-4-1-2-5-10(9)14(17)18/h1-2,4-5,13H,3,6-8H2,(H,15,16)/t12-/m0/s1


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