methyl (2R,3R)-2-azanyl-3-(4-bromophenyl)-4-nitro-butanoate

Systemtic Name: methyl (2R,3R)-2-azanyl-3-(4-bromophenyl)-4-nitro-butanoate Openeye Name: methyl (2R,3R)-2-amino-3-(4-bromophenyl)-4-nitro-butanoate CAS Name: (2R,3R)-2-amino-3-(4-bromophenyl)-4-nitrobutanoic acid methyl ester IUPAC Name: methyl (2R,3R)-2-amino-3-(4-bromophenyl)-4-nitrobutanoate Traditional Name: (2R,3R)-2-amino-3-(4-bromophenyl)-4-nitro-butyric acid methyl ester Formula: C11H13BrN2O4 MolecularWeight: 317.13592

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13BrN2O4/c1-18-11(15)10(13)9(6-14(16)17)7-2-4-8(12)5-3-7/h2-5,9-10H,6,13H2,1H3/t9-,10+/m0/s1