(3S,4R)-3-methyl-5-nitro-4-(3-nitrophenyl)pentan-2-one

Systemtic Name: (3S,4R)-3-methyl-5-nitro-4-(3-nitrophenyl)pentan-2-one Openeye Name: (3S,4R)-3-methyl-5-nitro-4-(3-nitrophenyl)pentan-2-one CAS Name: (3S,4R)-3-methyl-5-nitro-4-(3-nitrophenyl)-2-pentanone IUPAC Name: (3S,4R)-3-methyl-5-nitro-4-(3-nitrophenyl)pentan-2-one Traditional Name: (3S,4R)-3-methyl-5-nitro-4-(3-nitrophenyl)pentan-2-one Formula: C12H14N2O5 MolecularWeight: 266.24996

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14N2O5/c1-8(9(2)15)12(7-13(16)17)10-4-3-5-11(6-10)14(18)19/h3-6,8,12H,7H2,1-2H3/t8-,12-/m1/s1