3-[4-(4-chlorophenyl)butyl]-1H-imidazol-3-ium; dihydrogen phosphate

Systemtic Name: 3-[4-(4-chlorophenyl)butyl]-1H-imidazol-3-ium; dihydrogen phosphate Openeye Name: 3-[4-(4-chlorophenyl)butyl]-1H-imidazol-3-ium; dihydrogen phosphate CAS Name: 3-[4-(4-chlorophenyl)butyl]-1H-imidazol-3-ium; dihydrogen phosphate IUPAC Name: 3-[4-(4-chlorophenyl)butyl]-1H-imidazol-3-ium; dihydrogen phosphate Traditional Name: 3-[4-(4-chlorophenyl)butyl]-1H-imidazol-3-ium; dihydrogen phosphate Formula: C13H18ClN2O4P MolecularWeight: 332.719781

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCCC[N+]2=CNC=C2)Cl.OP(=O)(O)[O-]

Isomeric SMILES

C1=CC(=CC=C1CCCC[N+]2=CNC=C2)Cl.OP(=O)(O)[O-]

InChI

InChI=1S/C13H15ClN2.H3O4P/c14-13-6-4-12(5-7-13)3-1-2-9-16-10-8-15-11-16;1-5(2,3)4/h4-8,10-11H,1-3,9H2;(H3,1,2,3,4)