N4-[4-chloranyl-2-(phenylcarbonyl)phenyl]-N5-(phenylmethyl)-1H-imidazol-3-ium-4,5-dicarboxamide

Systemtic Name: N4-[4-chloranyl-2-(phenylcarbonyl)phenyl]-N5-(phenylmethyl)-1H-imidazol-3-ium-4,5-dicarboxamide Openeye Name: N4-(2-benzoyl-4-chloro-phenyl)-N5-benzyl-1H-imidazol-3-ium-4,5-dicarboxamide CAS Name: N4-(2-benzoyl-4-chlorophenyl)-N5-(phenylmethyl)-1H-imidazol-3-ium-4,5-dicarboxamide IUPAC Name: 4-N-(2-benzoyl-4-chlorophenyl)-5-N-benzyl-1H-imidazol-3-ium-4,5-dicarboxamide Traditional Name: N-(2-benzoyl-4-chloro-phenyl)-N'-benzyl-1H-imidazol-3-ium-4,5-dicarboxamide Formula: C25H20ClN4O3+ MolecularWeight: 459.9043

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)C2=C([NH+]=CN2)C(=O)NC3=C(C=C(C=C3)Cl)C(=O)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)C2=C([NH+]=CN2)C(=O)NC3=C(C=C(C=C3)Cl)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C25H19ClN4O3/c26-18-11-12-20(19(13-18)23(31)17-9-5-2-6-10-17)30-25(33)22-21(28-15-29-22)24(32)27-14-16-7-3-1-4-8-16/h1-13,15H,14H2,(H,27,32)(H,28,29)(H,30,33)/p+1