2-(2,4-dichlorophenyl)-1-imidazol-1-yl-3-(1-phenylpiperazin-1-ium-1-yl)propan-2-ol

Systemtic Name: 2-(2,4-dichlorophenyl)-1-imidazol-1-yl-3-(1-phenylpiperazin-1-ium-1-yl)propan-2-ol Openeye Name: 2-(2,4-dichlorophenyl)-1-imidazol-1-yl-3-(1-phenylpiperazin-1-ium-1-yl)propan-2-ol CAS Name: 2-(2,4-dichlorophenyl)-1-(1-imidazolyl)-3-(1-phenyl-1-piperazin-1-iumyl)-2-propanol IUPAC Name: 2-(2,4-dichlorophenyl)-1-imidazol-1-yl-3-(1-phenylpiperazin-1-ium-1-yl)propan-2-ol Traditional Name: 2-(2,4-dichlorophenyl)-1-imidazol-1-yl-3-(1-phenylpiperazin-1-ium-1-yl)propan-2-ol Formula: C22H25Cl2N4O+ MolecularWeight: 432.3661

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Descriptors Computed from Structure

Canonical SMILES:

C1C[N+](CCN1)(CC(CN2C=CN=C2)(C3=C(C=C(C=C3)Cl)Cl)O)C4=CC=CC=C4

Isomeric SMILES

C1C[N+](CCN1)(CC(CN2C=CN=C2)(C3=C(C=C(C=C3)Cl)Cl)O)C4=CC=CC=C4

InChI

InChI=1S/C22H25Cl2N4O/c23-18-6-7-20(21(24)14-18)22(29,15-27-11-8-26-17-27)16-28(12-9-25-10-13-28)19-4-2-1-3-5-19/h1-8,11,14,17,25,29H,9-10,12-13,15-16H2/q+1