N-(3-bromophenyl)-2-tert-butyl-4,6-dinitro-aniline

Systemtic Name: N-(3-bromophenyl)-2-tert-butyl-4,6-dinitro-aniline Openeye Name: N-(3-bromophenyl)-2-tert-butyl-4,6-dinitro-aniline CAS Name: N-(3-bromophenyl)-2-tert-butyl-4,6-dinitroaniline IUPAC Name: N-(3-bromophenyl)-2-tert-butyl-4,6-dinitroaniline Traditional Name: (3-bromophenyl)-(2-tert-butyl-4,6-dinitro-phenyl)amine Formula: C16H16BrN3O4 MolecularWeight: 394.21994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1NC2=CC(=CC=C2)Br)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1NC2=CC(=CC=C2)Br)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C16H16BrN3O4/c1-16(2,3)13-8-12(19(21)22)9-14(20(23)24)15(13)18-11-6-4-5-10(17)7-11/h4-9,18H,1-3H3