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

Systemtic Name: methyl 1-[2-[2-(4-fluorophenyl)-1H-indol-3-yl]-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxylate Openeye Name: methyl 1-[2-[2-(4-fluorophenyl)-1H-indol-3-yl]-2-oxo-ethyl]piperidin-1-ium-4-carboxylate CAS Name: 1-[2-[2-(4-fluorophenyl)-1H-indol-3-yl]-2-oxoethyl]-4-piperidin-1-iumcarboxylic acid methyl ester IUPAC Name: methyl 1-[2-[2-(4-fluorophenyl)-1H-indol-3-yl]-2-oxoethyl]piperidin-1-ium-4-carboxylate Traditional Name: 1-[2-[2-(4-fluorophenyl)-1H-indol-3-yl]-2-keto-ethyl]piperidin-1-ium-4-carboxylic acid methyl ester Formula: C23H24FN2O3+ MolecularWeight: 395.446663

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC[NH+](CC1)CC(=O)C2=C(NC3=CC=CC=C32)C4=CC=C(C=C4)F

Isomeric SMILES

COC(=O)C1CC[NH+](CC1)CC(=O)C2=C(NC3=CC=CC=C32)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H23FN2O3/c1-29-23(28)16-10-12-26(13-11-16)14-20(27)21-18-4-2-3-5-19(18)25-22(21)15-6-8-17(24)9-7-15/h2-9,16,25H,10-14H2,1H3/p+1