1-[2-[(3-fluorophenyl)methyl-methyl-amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[2-[(3-fluorophenyl)methyl-methyl-amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[2-[(3-fluorophenyl)methyl-methyl-amino]-2-oxo-ethyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[2-[(3-fluorophenyl)methyl-methylamino]-2-oxoethyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[2-[(3-fluorophenyl)methyl-methylamino]-2-oxoethyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-[2-[(3-fluorobenzyl)-methyl-amino]-2-keto-ethyl]piperidin-1-ium-4-carboxamide Formula: C16H23FN3O2+ MolecularWeight: 308.371123

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=CC=C1)F)C(=O)C[NH+]2CCC(CC2)C(=O)N

Isomeric SMILES

CN(CC1=CC(=CC=C1)F)C(=O)C[NH+]2CCC(CC2)C(=O)N

InChI

InChI=1S/C16H22FN3O2/c1-19(10-12-3-2-4-14(17)9-12)15(21)11-20-7-5-13(6-8-20)16(18)22/h2-4,9,13H,5-8,10-11H2,1H3,(H2,18,22)/p+1