tert-butyl-[(4-fluorophenyl)methyl]-[[5-(propylcarbamoyl)furan-2-yl]methyl]azanium

Systemtic Name: tert-butyl-[(4-fluorophenyl)methyl]-[[5-(propylcarbamoyl)furan-2-yl]methyl]azanium Openeye Name: tert-butyl-[(4-fluorophenyl)methyl]-[[5-(propylcarbamoyl)-2-furyl]methyl]ammonium CAS Name: tert-butyl-[(4-fluorophenyl)methyl]-[[5-[oxo(propylamino)methyl]-2-furanyl]methyl]ammonium IUPAC Name: tert-butyl-[(4-fluorophenyl)methyl]-[[5-(propylcarbamoyl)furan-2-yl]methyl]azanium Traditional Name: tert-butyl-(4-fluorobenzyl)-[[5-(propylcarbamoyl)-2-furyl]methyl]ammonium Formula: C20H28FN2O2+ MolecularWeight: 347.446923

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H27FN2O2/c1-5-12-22-19(24)18-11-10-17(25-18)14-23(20(2,3)4)13-15-6-8-16(21)9-7-15/h6-11H,5,12-14H2,1-4H3,(H,22,24)/p+1