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

Systemtic Name: 1-[4-(4-chlorophenyl)butyl]-3-propyl-imidazol-3-ium; dihydrogen phosphate Openeye Name: 1-[4-(4-chlorophenyl)butyl]-3-propyl-imidazol-3-ium; dihydrogen phosphate CAS Name: 1-[4-(4-chlorophenyl)butyl]-3-propylimidazol-3-ium; dihydrogen phosphate IUPAC Name: 1-[4-(4-chlorophenyl)butyl]-3-propylimidazol-3-ium; dihydrogen phosphate Traditional Name: 1-[4-(4-chlorophenyl)butyl]-3-propyl-imidazol-3-ium; dihydrogen phosphate Formula: C16H24ClN2O4P MolecularWeight: 374.799521

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC[N+]1=CN(C=C1)CCCCC2=CC=C(C=C2)Cl.OP(=O)(O)[O-]

Isomeric SMILES

CCC[N+]1=CN(C=C1)CCCCC2=CC=C(C=C2)Cl.OP(=O)(O)[O-]

InChI

InChI=1S/C16H22ClN2.H3O4P/c1-2-10-18-12-13-19(14-18)11-4-3-5-15-6-8-16(17)9-7-15;1-5(2,3)4/h6-9,12-14H,2-5,10-11H2,1H3;(H3,1,2,3,4)/q+1;/p-1