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

Systemtic Name: 1-[4-(4-chlorophenyl)butyl]-3-pentyl-imidazol-3-ium; dihydrogen phosphate Openeye Name: 1-[4-(4-chlorophenyl)butyl]-3-pentyl-imidazol-3-ium; dihydrogen phosphate CAS Name: 1-[4-(4-chlorophenyl)butyl]-3-pentylimidazol-3-ium; dihydrogen phosphate IUPAC Name: 1-[4-(4-chlorophenyl)butyl]-3-pentylimidazol-3-ium; dihydrogen phosphate Traditional Name: 1-amyl-3-[4-(4-chlorophenyl)butyl]imidazol-1-ium; dihydrogen phosphate Formula: C18H28ClN2O4P MolecularWeight: 402.852681

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H26ClN2.H3O4P/c1-2-3-5-12-20-14-15-21(16-20)13-6-4-7-17-8-10-18(19)11-9-17;1-5(2,3)4/h8-11,14-16H,2-7,12-13H2,1H3;(H3,1,2,3,4)/q+1;/p-1