[2-[(1-ethoxycarbonylpiperidin-4-yl)amino]-2-oxidanylidene-ethyl]-[(3-fluorophenyl)methyl]-methyl-azanium

Systemtic Name: [2-[(1-ethoxycarbonylpiperidin-4-yl)amino]-2-oxidanylidene-ethyl]-[(3-fluorophenyl)methyl]-methyl-azanium Openeye Name: [2-[(1-ethoxycarbonyl-4-piperidyl)amino]-2-oxo-ethyl]-[(3-fluorophenyl)methyl]-methyl-ammonium CAS Name: [2-[(1-ethoxycarbonyl-4-piperidinyl)amino]-2-oxoethyl]-[(3-fluorophenyl)methyl]-methylammonium IUPAC Name: [2-[(1-ethoxycarbonylpiperidin-4-yl)amino]-2-oxoethyl]-[(3-fluorophenyl)methyl]-methylazanium Traditional Name: [2-[(1-carbethoxy-4-piperidyl)amino]-2-keto-ethyl]-(3-fluorobenzyl)-methyl-ammonium Formula: C18H27FN3O3+ MolecularWeight: 352.423683

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H26FN3O3/c1-3-25-18(24)22-9-7-16(8-10-22)20-17(23)13-21(2)12-14-5-4-6-15(19)11-14/h4-6,11,16H,3,7-10,12-13H2,1-2H3,(H,20,23)/p+1