(2S,5R)-2-(1,3-benzodioxol-5-yl)-5-(4-nitrophenyl)-1,3-oxazolidin-3-ium

Systemtic Name: (2S,5R)-2-(1,3-benzodioxol-5-yl)-5-(4-nitrophenyl)-1,3-oxazolidin-3-ium Openeye Name: (2S,5R)-2-(1,3-benzodioxol-5-yl)-5-(4-nitrophenyl)oxazolidin-3-ium CAS Name: (2S,5R)-2-(1,3-benzodioxol-5-yl)-5-(4-nitrophenyl)oxazolidin-3-ium IUPAC Name: (2S,5R)-2-(1,3-benzodioxol-5-yl)-5-(4-nitrophenyl)-1,3-oxazolidin-3-ium Traditional Name: (2S,5R)-2-(1,3-benzodioxol-5-yl)-5-(4-nitrophenyl)oxazolidin-3-ium Formula: C16H15N2O5+ MolecularWeight: 315.3007

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC([NH2+]1)C2=CC3=C(C=C2)OCO3)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1[C@H](O[C@H]([NH2+]1)C2=CC3=C(C=C2)OCO3)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C16H14N2O5/c19-18(20)12-4-1-10(2-5-12)15-8-17-16(23-15)11-3-6-13-14(7-11)22-9-21-13/h1-7,15-17H,8-9H2/p+1/t15-,16-/m0/s1