methyl 2-[2-(6-bromanyl-3-nitro-indol-1-yl)ethanoylamino]ethanoate

Systemtic Name: methyl 2-[2-(6-bromanyl-3-nitro-indol-1-yl)ethanoylamino]ethanoate Openeye Name: methyl 2-[[2-(6-bromo-3-nitro-indol-1-yl)acetyl]amino]acetate CAS Name: 2-[[2-(6-bromo-3-nitro-1-indolyl)-1-oxoethyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[2-(6-bromo-3-nitroindol-1-yl)acetyl]amino]acetate Traditional Name: 2-[[2-(6-bromo-3-nitro-indol-1-yl)acetyl]amino]acetic acid methyl ester Formula: C13H12BrN3O5 MolecularWeight: 370.15548

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CNC(=O)CN1C=C(C2=C1C=C(C=C2)Br)[N+](=O)[O-]

Isomeric SMILES

COC(=O)CNC(=O)CN1C=C(C2=C1C=C(C=C2)Br)[N+](=O)[O-]

InChI

InChI=1S/C13H12BrN3O5/c1-22-13(19)5-15-12(18)7-16-6-11(17(20)21)9-3-2-8(14)4-10(9)16/h2-4,6H,5,7H2,1H3,(H,15,18)