(2R,3S)-3-(4-bromophenyl)-2-ethyl-4-nitro-butanal

Systemtic Name: (2R,3S)-3-(4-bromophenyl)-2-ethyl-4-nitro-butanal Openeye Name: (2R,3S)-3-(4-bromophenyl)-2-ethyl-4-nitro-butanal CAS Name: (2R,3S)-3-(4-bromophenyl)-2-ethyl-4-nitrobutanal IUPAC Name: (2R,3S)-3-(4-bromophenyl)-2-ethyl-4-nitrobutanal Traditional Name: (2R,3S)-3-(4-bromophenyl)-2-ethyl-4-nitro-butyraldehyde Formula: C12H14BrNO3 MolecularWeight: 300.14846

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14BrNO3/c1-2-9(8-15)12(7-14(16)17)10-3-5-11(13)6-4-10/h3-6,8-9,12H,2,7H2,1H3/t9-,12-/m0/s1