ethyl 4-[(4-fluoranyl-1-benzothiophen-2-yl)carbonyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[(4-fluoranyl-1-benzothiophen-2-yl)carbonyl]piperazine-1-carboxylate Openeye Name: ethyl 4-(4-fluorobenzothiophene-2-carbonyl)piperazine-1-carboxylate CAS Name: 4-[(4-fluoro-1-benzothiophen-2-yl)-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-fluoro-1-benzothiophene-2-carbonyl)piperazine-1-carboxylate Traditional Name: 4-(4-fluorobenzothiophene-2-carbonyl)piperazine-1-carboxylic acid ethyl ester Formula: C16H17FN2O3S MolecularWeight: 336.381183

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2=CC3=C(C=CC=C3S2)F

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=CC3=C(C=CC=C3S2)F

InChI

InChI=1S/C16H17FN2O3S/c1-2-22-16(21)19-8-6-18(7-9-19)15(20)14-10-11-12(17)4-3-5-13(11)23-14/h3-5,10H,2,6-9H2,1H3