[3,4-bis(fluoranyl)phenyl]methyl-(1-ethoxycarbonylpiperidin-4-yl)azanium

Systemtic Name: [3,4-bis(fluoranyl)phenyl]methyl-(1-ethoxycarbonylpiperidin-4-yl)azanium Openeye Name: (3,4-difluorophenyl)methyl-(1-ethoxycarbonyl-4-piperidyl)ammonium CAS Name: (3,4-difluorophenyl)methyl-(1-ethoxycarbonyl-4-piperidinyl)ammonium IUPAC Name: (3,4-difluorophenyl)methyl-(1-ethoxycarbonylpiperidin-4-yl)azanium Traditional Name: (1-carbethoxy-4-piperidyl)-(3,4-difluorobenzyl)ammonium Formula: C15H21F2N2O2+ MolecularWeight: 299.336246

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)[NH2+]CC2=CC(=C(C=C2)F)F

Isomeric SMILES

CCOC(=O)N1CCC(CC1)[NH2+]CC2=CC(=C(C=C2)F)F

InChI

InChI=1S/C15H20F2N2O2/c1-2-21-15(20)19-7-5-12(6-8-19)18-10-11-3-4-13(16)14(17)9-11/h3-4,9,12,18H,2,5-8,10H2,1H3/p+1