(2S)-3-nitro-1-(phenylmethyl)pyrrolidin-1-ium-3-id-2-olate

Systemtic Name: (2S)-3-nitro-1-(phenylmethyl)pyrrolidin-1-ium-3-id-2-olate Openeye Name: (2S)-1-benzyl-3-nitro-pyrrolidin-1-ium-3-id-2-olate CAS Name: (2S)-3-nitro-1-(phenylmethyl)-2-pyrrolidin-1-ium-3-idolate IUPAC Name: (2S)-1-benzyl-3-nitropyrrolidin-1-ium-3-id-2-olate Traditional Name: (2S)-1-benzyl-3-nitro-pyrrolidin-1-ium-3-id-2-olate Formula: C11H13N2O3- MolecularWeight: 221.23252

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](C([C-]1[N+](=O)[O-])[O-])CC2=CC=CC=C2

Isomeric SMILES

C1C[NH+]([C@H]([C-]1[N+](=O)[O-])[O-])CC2=CC=CC=C2

InChI

InChI=1S/C11H12N2O3/c14-11-10(13(15)16)6-7-12(11)8-9-4-2-1-3-5-9/h1-5,11H,6-8H2/q-2/p+1/t11-/m0/s1