[(2R,3R)-1,3-dinitrobutan-2-yl]benzene

Systemtic Name: [(2R,3R)-1,3-dinitrobutan-2-yl]benzene Openeye Name: [(1R,2R)-2-nitro-1-(nitromethyl)propyl]benzene CAS Name: [(2R,3R)-1,3-dinitrobutan-2-yl]benzene IUPAC Name: [(2R,3R)-1,3-dinitrobutan-2-yl]benzene Traditional Name: [(1R,2R)-2-nitro-1-(nitromethyl)propyl]benzene Formula: C10H12N2O4 MolecularWeight: 224.21328

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C[N+](=O)[O-])C1=CC=CC=C1)[N+](=O)[O-]

Isomeric SMILES

C[C@H]([C@@H](C[N+](=O)[O-])C1=CC=CC=C1)[N+](=O)[O-]

InChI

InChI=1S/C10H12N2O4/c1-8(12(15)16)10(7-11(13)14)9-5-3-2-4-6-9/h2-6,8,10H,7H2,1H3/t8-,10-/m1/s1