5-[[5-(cycloheptylmethyl)-2-(4-dimethylaminophenyl)-1H-imidazol-4-yl]carbonylamino]benzene-1,3-dicarboxylic acid

Systemtic Name: 5-[[5-(cycloheptylmethyl)-2-(4-dimethylaminophenyl)-1H-imidazol-4-yl]carbonylamino]benzene-1,3-dicarboxylic acid Openeye Name: 5-[[5-(cycloheptylmethyl)-2-(4-dimethylaminophenyl)-1H-imidazole-4-carbonyl]amino]benzene-1,3-dicarboxylic acid CAS Name: 5-[[[5-(cycloheptylmethyl)-2-(4-dimethylaminophenyl)-1H-imidazol-4-yl]-oxomethyl]amino]benzene-1,3-dicarboxylic acid IUPAC Name: 5-[[5-(cycloheptylmethyl)-2-(4-dimethylaminophenyl)-1H-imidazole-4-carbonyl]amino]benzene-1,3-dicarboxylic acid Traditional Name: 5-[[5-(cycloheptylmethyl)-2-(4-dimethylaminophenyl)-1H-imidazole-4-carbonyl]amino]isophthalic acid Formula: C28H32N4O5 MolecularWeight: 504.57748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C2=NC(=C(N2)CC3CCCCCC3)C(=O)NC4=CC(=CC(=C4)C(=O)O)C(=O)O

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C2=NC(=C(N2)CC3CCCCCC3)C(=O)NC4=CC(=CC(=C4)C(=O)O)C(=O)O

InChI

InChI=1S/C28H32N4O5/c1-32(2)22-11-9-18(10-12-22)25-30-23(13-17-7-5-3-4-6-8-17)24(31-25)26(33)29-21-15-19(27(34)35)14-20(16-21)28(36)37/h9-12,14-17H,3-8,13H2,1-2H3,(H,29,33)(H,30,31)(H,34,35)(H,36,37)