ethyl 1-[4-[(2-fluoranylphenoxy)methyl]thiophen-2-yl]carbonylpiperidine-3-carboxylate

Systemtic Name: ethyl 1-[4-[(2-fluoranylphenoxy)methyl]thiophen-2-yl]carbonylpiperidine-3-carboxylate Openeye Name: ethyl 1-[4-[(2-fluorophenoxy)methyl]thiophene-2-carbonyl]piperidine-3-carboxylate CAS Name: 1-[[4-[(2-fluorophenoxy)methyl]-2-thiophenyl]-oxomethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[4-[(2-fluorophenoxy)methyl]thiophene-2-carbonyl]piperidine-3-carboxylate Traditional Name: 1-[4-[(2-fluorophenoxy)methyl]thiophene-2-carbonyl]nipecotic acid ethyl ester Formula: C20H22FNO4S MolecularWeight: 391.456383

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)C2=CC(=CS2)COC3=CC=CC=C3F

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)C2=CC(=CS2)COC3=CC=CC=C3F

InChI

InChI=1S/C20H22FNO4S/c1-2-25-20(24)15-6-5-9-22(11-15)19(23)18-10-14(13-27-18)12-26-17-8-4-3-7-16(17)21/h3-4,7-8,10,13,15H,2,5-6,9,11-12H2,1H3