[2-[(3-fluorophenyl)amino]-2-oxidanylidene-ethyl]-methyl-[(2S)-1-oxidanylidene-1-piperidin-1-yl-propan-2-yl]azanium

Systemtic Name: [2-[(3-fluorophenyl)amino]-2-oxidanylidene-ethyl]-methyl-[(2S)-1-oxidanylidene-1-piperidin-1-yl-propan-2-yl]azanium Openeye Name: [2-(3-fluoroanilino)-2-oxo-ethyl]-methyl-[(1S)-1-methyl-2-oxo-2-(1-piperidyl)ethyl]ammonium CAS Name: [2-(3-fluoroanilino)-2-oxoethyl]-methyl-[(2S)-1-oxo-1-(1-piperidinyl)propan-2-yl]ammonium IUPAC Name: [2-(3-fluoroanilino)-2-oxoethyl]-methyl-[(2S)-1-oxo-1-piperidin-1-ylpropan-2-yl]azanium Traditional Name: [2-(3-fluoroanilino)-2-keto-ethyl]-[(1S)-2-keto-1-methyl-2-piperidino-ethyl]-methyl-ammonium Formula: C17H25FN3O2+ MolecularWeight: 322.397703

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCCC1)[NH+](C)CC(=O)NC2=CC(=CC=C2)F

Isomeric SMILES

C[C@@H](C(=O)N1CCCCC1)[NH+](C)CC(=O)NC2=CC(=CC=C2)F

InChI

InChI=1S/C17H24FN3O2/c1-13(17(23)21-9-4-3-5-10-21)20(2)12-16(22)19-15-8-6-7-14(18)11-15/h6-8,11,13H,3-5,9-10,12H2,1-2H3,(H,19,22)/p+1/t13-/m0/s1