N1,N3-bis(4-bromanyl-2-methyl-phenyl)-5-nitro-benzene-1,3-dicarboxamide

Systemtic Name: N1,N3-bis(4-bromanyl-2-methyl-phenyl)-5-nitro-benzene-1,3-dicarboxamide Openeye Name: N1,N3-bis(4-bromo-2-methyl-phenyl)-5-nitro-benzene-1,3-dicarboxamide CAS Name: N1,N3-bis(4-bromo-2-methylphenyl)-5-nitrobenzene-1,3-dicarboxamide IUPAC Name: 1-N,3-N-bis(4-bromo-2-methylphenyl)-5-nitrobenzene-1,3-dicarboxamide Traditional Name: N,N'-bis(4-bromo-2-methyl-phenyl)-5-nitro-isophthalamide Formula: C22H17Br2N3O4 MolecularWeight: 547.19608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])C(=O)NC3=C(C=C(C=C3)Br)C

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])C(=O)NC3=C(C=C(C=C3)Br)C

InChI

InChI=1S/C22H17Br2N3O4/c1-12-7-16(23)3-5-19(12)25-21(28)14-9-15(11-18(10-14)27(30)31)22(29)26-20-6-4-17(24)8-13(20)2/h3-11H,1-2H3,(H,25,28)(H,26,29)