cyclohexyl-[(3-fluorophenyl)methyl]-[[5-(propylcarbamoyl)furan-2-yl]methyl]azanium

Systemtic Name: cyclohexyl-[(3-fluorophenyl)methyl]-[[5-(propylcarbamoyl)furan-2-yl]methyl]azanium Openeye Name: cyclohexyl-[(3-fluorophenyl)methyl]-[[5-(propylcarbamoyl)-2-furyl]methyl]ammonium CAS Name: cyclohexyl-[(3-fluorophenyl)methyl]-[[5-[oxo(propylamino)methyl]-2-furanyl]methyl]ammonium IUPAC Name: cyclohexyl-[(3-fluorophenyl)methyl]-[[5-(propylcarbamoyl)furan-2-yl]methyl]azanium Traditional Name: cyclohexyl-(3-fluorobenzyl)-[[5-(propylcarbamoyl)-2-furyl]methyl]ammonium Formula: C22H30FN2O2+ MolecularWeight: 373.484203

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=CC=C(O1)C[NH+](CC2=CC(=CC=C2)F)C3CCCCC3

Isomeric SMILES

CCCNC(=O)C1=CC=C(O1)C[NH+](CC2=CC(=CC=C2)F)C3CCCCC3

InChI

InChI=1S/C22H29FN2O2/c1-2-13-24-22(26)21-12-11-20(27-21)16-25(19-9-4-3-5-10-19)15-17-7-6-8-18(23)14-17/h6-8,11-12,14,19H,2-5,9-10,13,15-16H2,1H3,(H,24,26)/p+1