methyl 4-fluoranyl-3-[(1-thiophen-2-ylcarbonylpiperidin-3-yl)carbonylamino]benzoate

Systemtic Name: methyl 4-fluoranyl-3-[(1-thiophen-2-ylcarbonylpiperidin-3-yl)carbonylamino]benzoate Openeye Name: methyl 4-fluoro-3-[[1-(thiophene-2-carbonyl)piperidine-3-carbonyl]amino]benzoate CAS Name: 4-fluoro-3-[[oxo-[1-[oxo(thiophen-2-yl)methyl]-3-piperidinyl]methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-fluoro-3-[[1-(thiophene-2-carbonyl)piperidine-3-carbonyl]amino]benzoate Traditional Name: 4-fluoro-3-[[1-(2-thenoyl)nipecotoyl]amino]benzoic acid methyl ester Formula: C19H19FN2O4S MolecularWeight: 390.428563

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)F)NC(=O)C2CCCN(C2)C(=O)C3=CC=CS3

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)F)NC(=O)C2CCCN(C2)C(=O)C3=CC=CS3

InChI

InChI=1S/C19H19FN2O4S/c1-26-19(25)12-6-7-14(20)15(10-12)21-17(23)13-4-2-8-22(11-13)18(24)16-5-3-9-27-16/h3,5-7,9-10,13H,2,4,8,11H2,1H3,(H,21,23)