dihydrogen phosphate; 1-(4,4-diphenylbutyl)-3-heptyl-imidazol-1-ium

Systemtic Name: dihydrogen phosphate; 1-(4,4-diphenylbutyl)-3-heptyl-imidazol-1-ium Openeye Name: dihydrogen phosphate; 1-(4,4-diphenylbutyl)-3-heptyl-imidazol-1-ium CAS Name: dihydrogen phosphate; 1-(4,4-diphenylbutyl)-3-heptylimidazol-1-ium IUPAC Name: dihydrogen phosphate; 1-(4,4-diphenylbutyl)-3-heptylimidazol-1-ium Traditional Name: dihydrogen phosphate; 1-(4,4-diphenylbutyl)-3-heptyl-imidazol-1-ium Formula: C26H37N2O4P MolecularWeight: 472.556741

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN1C=C[N+](=C1)CCCC(C2=CC=CC=C2)C3=CC=CC=C3.OP(=O)(O)[O-]

Isomeric SMILES

CCCCCCCN1C=C[N+](=C1)CCCC(C2=CC=CC=C2)C3=CC=CC=C3.OP(=O)(O)[O-]

InChI

InChI=1S/C26H35N2.H3O4P/c1-2-3-4-5-12-19-27-21-22-28(23-27)20-13-18-26(24-14-8-6-9-15-24)25-16-10-7-11-17-25;1-5(2,3)4/h6-11,14-17,21-23,26H,2-5,12-13,18-20H2,1H3;(H3,1,2,3,4)/q+1;/p-1