ethyl 3-[(2-fluorophenyl)methyl]-1-[2-(furan-2-yl)-2-oxidanylidene-ethanoyl]piperidine-3-carboxylate

Systemtic Name: ethyl 3-[(2-fluorophenyl)methyl]-1-[2-(furan-2-yl)-2-oxidanylidene-ethanoyl]piperidine-3-carboxylate Openeye Name: ethyl 3-[(2-fluorophenyl)methyl]-1-[2-(2-furyl)-2-oxo-acetyl]piperidine-3-carboxylate CAS Name: 3-[(2-fluorophenyl)methyl]-1-[2-(2-furanyl)-1,2-dioxoethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[(2-fluorophenyl)methyl]-1-[2-(furan-2-yl)-2-oxoacetyl]piperidine-3-carboxylate Traditional Name: 3-(2-fluorobenzyl)-1-[2-(2-furyl)-2-keto-acetyl]nipecotic acid ethyl ester Formula: C21H22FNO5 MolecularWeight: 387.401483

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCCN(C1)C(=O)C(=O)C2=CC=CO2)CC3=CC=CC=C3F

Isomeric SMILES

CCOC(=O)C1(CCCN(C1)C(=O)C(=O)C2=CC=CO2)CC3=CC=CC=C3F

InChI

InChI=1S/C21H22FNO5/c1-2-27-20(26)21(13-15-7-3-4-8-16(15)22)10-6-11-23(14-21)19(25)18(24)17-9-5-12-28-17/h3-5,7-9,12H,2,6,10-11,13-14H2,1H3