ethyl 1-[2-(5-fluoranyl-1H-indol-3-yl)-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxylate

Systemtic Name: ethyl 1-[2-(5-fluoranyl-1H-indol-3-yl)-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxylate Openeye Name: ethyl 1-[2-(5-fluoro-1H-indol-3-yl)-2-oxo-ethyl]piperidin-1-ium-4-carboxylate CAS Name: 1-[2-(5-fluoro-1H-indol-3-yl)-2-oxoethyl]-4-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(5-fluoro-1H-indol-3-yl)-2-oxoethyl]piperidin-1-ium-4-carboxylate Traditional Name: 1-[2-(5-fluoro-1H-indol-3-yl)-2-keto-ethyl]piperidin-1-ium-4-carboxylic acid ethyl ester Formula: C18H22FN2O3+ MolecularWeight: 333.377283

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC[NH+](CC1)CC(=O)C2=CNC3=C2C=C(C=C3)F

Isomeric SMILES

CCOC(=O)C1CC[NH+](CC1)CC(=O)C2=CNC3=C2C=C(C=C3)F

InChI

InChI=1S/C18H21FN2O3/c1-2-24-18(23)12-5-7-21(8-6-12)11-17(22)15-10-20-16-4-3-13(19)9-14(15)16/h3-4,9-10,12,20H,2,5-8,11H2,1H3/p+1