[(3R)-1-[(2-fluorophenyl)methyl]-3-oxidanyl-2-oxidanylidene-piperidin-3-yl]methyl-(1-methylpiperidin-1-ium-4-yl)azanium

Systemtic Name: [(3R)-1-[(2-fluorophenyl)methyl]-3-oxidanyl-2-oxidanylidene-piperidin-3-yl]methyl-(1-methylpiperidin-1-ium-4-yl)azanium Openeye Name: [(3R)-1-[(2-fluorophenyl)methyl]-3-hydroxy-2-oxo-3-piperidyl]methyl-(1-methylpiperidin-1-ium-4-yl)ammonium CAS Name: [(3R)-1-[(2-fluorophenyl)methyl]-3-hydroxy-2-oxo-3-piperidinyl]methyl-(1-methyl-4-piperidin-1-iumyl)ammonium IUPAC Name: [(3R)-1-[(2-fluorophenyl)methyl]-3-hydroxy-2-oxopiperidin-3-yl]methyl-(1-methylpiperidin-1-ium-4-yl)azanium Traditional Name: [(3R)-1-(2-fluorobenzyl)-3-hydroxy-2-keto-3-piperidyl]methyl-(1-methylpiperidin-1-ium-4-yl)ammonium Formula: C19H30FN3O2+2 MolecularWeight: 351.458803

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)[NH2+]CC2(CCCN(C2=O)CC3=CC=CC=C3F)O

Isomeric SMILES

C[NH+]1CCC(CC1)[NH2+]C[C@@]2(CCCN(C2=O)CC3=CC=CC=C3F)O

InChI

InChI=1S/C19H28FN3O2/c1-22-11-7-16(8-12-22)21-14-19(25)9-4-10-23(18(19)24)13-15-5-2-3-6-17(15)20/h2-3,5-6,16,21,25H,4,7-14H2,1H3/p+2/t19-/m1/s1