(4-fluorophenyl)methyl-(3-imidazol-1-ylpropyl)-[(4-morpholin-4-ylphenyl)methyl]azanium

Systemtic Name: (4-fluorophenyl)methyl-(3-imidazol-1-ylpropyl)-[(4-morpholin-4-ylphenyl)methyl]azanium Openeye Name: (4-fluorophenyl)methyl-(3-imidazol-1-ylpropyl)-[(4-morpholinophenyl)methyl]ammonium CAS Name: (4-fluorophenyl)methyl-[3-(1-imidazolyl)propyl]-[[4-(4-morpholinyl)phenyl]methyl]ammonium IUPAC Name: (4-fluorophenyl)methyl-(3-imidazol-1-ylpropyl)-[(4-morpholin-4-ylphenyl)methyl]azanium Traditional Name: (4-fluorobenzyl)-(3-imidazol-1-ylpropyl)-(4-morpholinobenzyl)ammonium Formula: C24H30FN4O+ MolecularWeight: 409.519603

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC=C(C=C2)C[NH+](CCCN3C=CN=C3)CC4=CC=C(C=C4)F

Isomeric SMILES

C1COCCN1C2=CC=C(C=C2)C[NH+](CCCN3C=CN=C3)CC4=CC=C(C=C4)F

InChI

InChI=1S/C24H29FN4O/c25-23-6-2-21(3-7-23)18-28(12-1-11-27-13-10-26-20-27)19-22-4-8-24(9-5-22)29-14-16-30-17-15-29/h2-10,13,20H,1,11-12,14-19H2/p+1