N1,N4-bis[4-(1-methyl-4,5-dihydroimidazol-2-yl)phenyl]-2-nitro-benzene-1,4-dicarboxamide

Systemtic Name: N1,N4-bis[4-(1-methyl-4,5-dihydroimidazol-2-yl)phenyl]-2-nitro-benzene-1,4-dicarboxamide Openeye Name: N1,N4-bis[4-(1-methyl-4,5-dihydroimidazol-2-yl)phenyl]-2-nitro-terephthalamide CAS Name: N1,N4-bis[4-(1-methyl-4,5-dihydroimidazol-2-yl)phenyl]-2-nitrobenzene-1,4-dicarboxamide IUPAC Name: 1-N,4-N-bis[4-(1-methyl-4,5-dihydroimidazol-2-yl)phenyl]-2-nitrobenzene-1,4-dicarboxamide Traditional Name: N,N'-bis[4-(1-methyl-2-imidazolin-2-yl)phenyl]-2-nitro-terephthalamide Formula: C28H27N7O4 MolecularWeight: 525.55848

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN=C1C2=CC=C(C=C2)NC(=O)C3=CC(=C(C=C3)C(=O)NC4=CC=C(C=C4)C5=NCCN5C)[N+](=O)[O-]

Isomeric SMILES

CN1CCN=C1C2=CC=C(C=C2)NC(=O)C3=CC(=C(C=C3)C(=O)NC4=CC=C(C=C4)C5=NCCN5C)[N+](=O)[O-]

InChI

InChI=1S/C28H27N7O4/c1-33-15-13-29-25(33)18-3-8-21(9-4-18)31-27(36)20-7-12-23(24(17-20)35(38)39)28(37)32-22-10-5-19(6-11-22)26-30-14-16-34(26)2/h3-12,17H,13-16H2,1-2H3,(H,31,36)(H,32,37)