2-[[1-(4-fluorophenyl)carbonylpiperidin-4-yl]carbonylamino]ethyl-di(propan-2-yl)azanium

Systemtic Name: 2-[[1-(4-fluorophenyl)carbonylpiperidin-4-yl]carbonylamino]ethyl-di(propan-2-yl)azanium Openeye Name: 2-[[1-(4-fluorobenzoyl)piperidine-4-carbonyl]amino]ethyl-diisopropyl-ammonium CAS Name: 2-[[[1-[(4-fluorophenyl)-oxomethyl]-4-piperidinyl]-oxomethyl]amino]ethyl-di(propan-2-yl)ammonium IUPAC Name: 2-[[1-(4-fluorobenzoyl)piperidine-4-carbonyl]amino]ethyl-di(propan-2-yl)azanium Traditional Name: 2-[[1-(4-fluorobenzoyl)isonipecotoyl]amino]ethyl-diisopropyl-ammonium Formula: C21H33FN3O2+ MolecularWeight: 378.504023

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+](CCNC(=O)C1CCN(CC1)C(=O)C2=CC=C(C=C2)F)C(C)C

Isomeric SMILES

CC(C)[NH+](CCNC(=O)C1CCN(CC1)C(=O)C2=CC=C(C=C2)F)C(C)C

InChI

InChI=1S/C21H32FN3O2/c1-15(2)25(16(3)4)14-11-23-20(26)17-9-12-24(13-10-17)21(27)18-5-7-19(22)8-6-18/h5-8,15-17H,9-14H2,1-4H3,(H,23,26)/p+1