N1,N4-bis(2-methyl-3-nitro-phenyl)benzene-1,4-dicarboxamide

Systemtic Name: N1,N4-bis(2-methyl-3-nitro-phenyl)benzene-1,4-dicarboxamide Openeye Name: N1,N4-bis(2-methyl-3-nitro-phenyl)terephthalamide CAS Name: N1,N4-bis(2-methyl-3-nitrophenyl)benzene-1,4-dicarboxamide IUPAC Name: 1-N,4-N-bis(2-methyl-3-nitrophenyl)benzene-1,4-dicarboxamide Traditional Name: N,N'-bis(2-methyl-3-nitro-phenyl)terephthalamide Formula: C22H18N4O6 MolecularWeight: 434.40152

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H18N4O6/c1-13-17(5-3-7-19(13)25(29)30)23-21(27)15-9-11-16(12-10-15)22(28)24-18-6-4-8-20(14(18)2)26(31)32/h3-12H,1-2H3,(H,23,27)(H,24,28)