4-(4-chlorophenyl)-2-[4-(4-methylpiperazin-1-yl)phenyl]-1H-imidazole-5-carboxylic acid

Systemtic Name: 4-(4-chlorophenyl)-2-[4-(4-methylpiperazin-1-yl)phenyl]-1H-imidazole-5-carboxylic acid Openeye Name: 4-(4-chlorophenyl)-2-[4-(4-methylpiperazin-1-yl)phenyl]-1H-imidazole-5-carboxylic acid CAS Name: 4-(4-chlorophenyl)-2-[4-(4-methyl-1-piperazinyl)phenyl]-1H-imidazole-5-carboxylic acid IUPAC Name: 4-(4-chlorophenyl)-2-[4-(4-methylpiperazin-1-yl)phenyl]-1H-imidazole-5-carboxylic acid Traditional Name: 4-(4-chlorophenyl)-2-[4-(4-methylpiperazino)phenyl]-1H-imidazole-5-carboxylic acid Formula: C21H21ClN4O2 MolecularWeight: 396.87004

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC=C(C=C2)C3=NC(=C(N3)C(=O)O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CN1CCN(CC1)C2=CC=C(C=C2)C3=NC(=C(N3)C(=O)O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H21ClN4O2/c1-25-10-12-26(13-11-25)17-8-4-15(5-9-17)20-23-18(19(24-20)21(27)28)14-2-6-16(22)7-3-14/h2-9H,10-13H2,1H3,(H,23,24)(H,27,28)