ethyl 1-[3-[(2-fluorophenyl)amino]-3-oxidanylidene-propyl]piperidin-1-ium-4-carboxylate

Systemtic Name: ethyl 1-[3-[(2-fluorophenyl)amino]-3-oxidanylidene-propyl]piperidin-1-ium-4-carboxylate Openeye Name: ethyl 1-[3-(2-fluoroanilino)-3-oxo-propyl]piperidin-1-ium-4-carboxylate CAS Name: 1-[3-(2-fluoroanilino)-3-oxopropyl]-4-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-(2-fluoroanilino)-3-oxopropyl]piperidin-1-ium-4-carboxylate Traditional Name: 1-[3-(2-fluoroanilino)-3-keto-propyl]piperidin-1-ium-4-carboxylic acid ethyl ester Formula: C17H24FN2O3+ MolecularWeight: 323.382463

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC[NH+](CC1)CCC(=O)NC2=CC=CC=C2F

Isomeric SMILES

CCOC(=O)C1CC[NH+](CC1)CCC(=O)NC2=CC=CC=C2F

InChI

InChI=1S/C17H23FN2O3/c1-2-23-17(22)13-7-10-20(11-8-13)12-9-16(21)19-15-6-4-3-5-14(15)18/h3-6,13H,2,7-12H2,1H3,(H,19,21)/p+1