N-(4-bromanyl-2-methyl-phenyl)-2-methyl-3,5-dinitro-benzamide

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-2-methyl-3,5-dinitro-benzamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-2-methyl-3,5-dinitro-benzamide CAS Name: N-(4-bromo-2-methylphenyl)-2-methyl-3,5-dinitrobenzamide IUPAC Name: N-(4-bromo-2-methylphenyl)-2-methyl-3,5-dinitrobenzamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-2-methyl-3,5-dinitro-benzamide Formula: C15H12BrN3O5 MolecularWeight: 394.17688

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)C2=CC(=CC(=C2C)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)C2=CC(=CC(=C2C)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C15H12BrN3O5/c1-8-5-10(16)3-4-13(8)17-15(20)12-6-11(18(21)22)7-14(9(12)2)19(23)24/h3-7H,1-2H3,(H,17,20)