N-[4-[(5-bromanyl-2-oxidanylidene-indol-3-yl)amino]-2-nitro-phenyl]-4-nitro-benzamide

Systemtic Name: N-[4-[(5-bromanyl-2-oxidanylidene-indol-3-yl)amino]-2-nitro-phenyl]-4-nitro-benzamide Openeye Name: N-[4-[(5-bromo-2-oxo-indol-3-yl)amino]-2-nitro-phenyl]-4-nitro-benzamide CAS Name: N-[4-[(5-bromo-2-oxo-3-indolyl)amino]-2-nitrophenyl]-4-nitrobenzamide IUPAC Name: N-[4-[(5-bromo-2-oxoindol-3-yl)amino]-2-nitrophenyl]-4-nitrobenzamide Traditional Name: N-[4-[(5-bromo-2-keto-indol-3-yl)amino]-2-nitro-phenyl]-4-nitro-benzamide Formula: C21H12BrN5O6 MolecularWeight: 510.25388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NC2=C(C=C(C=C2)NC3=C4C=C(C=CC4=NC3=O)Br)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)NC2=C(C=C(C=C2)NC3=C4C=C(C=CC4=NC3=O)Br)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C21H12BrN5O6/c22-12-3-7-16-15(9-12)19(21(29)24-16)23-13-4-8-17(18(10-13)27(32)33)25-20(28)11-1-5-14(6-2-11)26(30)31/h1-10H,(H,25,28)(H,23,24,29)