N-[5-(2-bromanyl-3-methyl-phenyl)-1H-1,2,4-triazol-3-yl]-2,2-dimethyl-3-(9-nitro-10H-anthracen-9-yl)propanamide

Systemtic Name: N-[5-(2-bromanyl-3-methyl-phenyl)-1H-1,2,4-triazol-3-yl]-2,2-dimethyl-3-(9-nitro-10H-anthracen-9-yl)propanamide Openeye Name: N-[5-(2-bromo-3-methyl-phenyl)-1H-1,2,4-triazol-3-yl]-2,2-dimethyl-3-(9-nitro-10H-anthracen-9-yl)propanamide CAS Name: N-[5-(2-bromo-3-methylphenyl)-1H-1,2,4-triazol-3-yl]-2,2-dimethyl-3-(9-nitro-10H-anthracen-9-yl)propanamide IUPAC Name: N-[5-(2-bromo-3-methylphenyl)-1H-1,2,4-triazol-3-yl]-2,2-dimethyl-3-(9-nitro-10H-anthracen-9-yl)propanamide Traditional Name: N-[5-(2-bromo-3-methyl-phenyl)-1H-1,2,4-triazol-3-yl]-2,2-dimethyl-3-(9-nitro-10H-anthracen-9-yl)propionamide Formula: C28H26BrN5O3 MolecularWeight: 560.44174

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1Br)C2=NC(=NN2)NC(=O)C(C)(C)CC3(C4=CC=CC=C4CC5=CC=CC=C53)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC(=C1Br)C2=NC(=NN2)NC(=O)C(C)(C)CC3(C4=CC=CC=C4CC5=CC=CC=C53)[N+](=O)[O-]

InChI

InChI=1S/C28H26BrN5O3/c1-17-9-8-12-20(23(17)29)24-30-26(33-32-24)31-25(35)27(2,3)16-28(34(36)37)21-13-6-4-10-18(21)15-19-11-5-7-14-22(19)28/h4-14H,15-16H2,1-3H3,(H2,30,31,32,33,35)