ethyl (2R)-4-(4-bromophenyl)-2-(nitromethyl)-4-oxidanylidene-butanoate

Systemtic Name: ethyl (2R)-4-(4-bromophenyl)-2-(nitromethyl)-4-oxidanylidene-butanoate Openeye Name: ethyl (2R)-4-(4-bromophenyl)-2-(nitromethyl)-4-oxo-butanoate CAS Name: (2R)-4-(4-bromophenyl)-2-(nitromethyl)-4-oxobutanoic acid ethyl ester IUPAC Name: ethyl (2R)-4-(4-bromophenyl)-2-(nitromethyl)-4-oxobutanoate Traditional Name: (2R)-4-(4-bromophenyl)-4-keto-2-(nitromethyl)butyric acid ethyl ester Formula: C13H14BrNO5 MolecularWeight: 344.15796

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14BrNO5/c1-2-20-13(17)10(8-15(18)19)7-12(16)9-3-5-11(14)6-4-9/h3-6,10H,2,7-8H2,1H3/t10-/m1/s1