2-[2-(4-bromophenyl)-2-oxidanylidene-ethyl]-5-nitro-isoindole-1,3-dione

Systemtic Name: 2-[2-(4-bromophenyl)-2-oxidanylidene-ethyl]-5-nitro-isoindole-1,3-dione Openeye Name: 2-[2-(4-bromophenyl)-2-oxo-ethyl]-5-nitro-isoindoline-1,3-dione CAS Name: 2-[2-(4-bromophenyl)-2-oxoethyl]-5-nitroisoindole-1,3-dione IUPAC Name: 2-[2-(4-bromophenyl)-2-oxoethyl]-5-nitroisoindole-1,3-dione Traditional Name: 2-[2-(4-bromophenyl)-2-keto-ethyl]-5-nitro-isoindoline-1,3-quinone Formula: C16H9BrN2O5 MolecularWeight: 389.15706

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)CN2C(=O)C3=C(C2=O)C=C(C=C3)[N+](=O)[O-])Br

Isomeric SMILES

C1=CC(=CC=C1C(=O)CN2C(=O)C3=C(C2=O)C=C(C=C3)[N+](=O)[O-])Br

InChI

InChI=1S/C16H9BrN2O5/c17-10-3-1-9(2-4-10)14(20)8-18-15(21)12-6-5-11(19(23)24)7-13(12)16(18)22/h1-7H,8H2