3-[(3-ethoxycarbonylpiperidin-1-yl)carbonylamino]-5-(4-fluorophenyl)thiophene-2-carboxylic acid

Systemtic Name: 3-[(3-ethoxycarbonylpiperidin-1-yl)carbonylamino]-5-(4-fluorophenyl)thiophene-2-carboxylic acid Openeye Name: 3-[(3-ethoxycarbonylpiperidine-1-carbonyl)amino]-5-(4-fluorophenyl)thiophene-2-carboxylic acid CAS Name: 3-[[(3-ethoxycarbonyl-1-piperidinyl)-oxomethyl]amino]-5-(4-fluorophenyl)-2-thiophenecarboxylic acid IUPAC Name: 3-[(3-ethoxycarbonylpiperidine-1-carbonyl)amino]-5-(4-fluorophenyl)thiophene-2-carboxylic acid Traditional Name: 3-[(3-carbethoxypiperidine-1-carbonyl)amino]-5-(4-fluorophenyl)-2-thenoic acid Formula: C20H21FN2O5S MolecularWeight: 420.454543

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)NC2=C(SC(=C2)C3=CC=C(C=C3)F)C(=O)O

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)NC2=C(SC(=C2)C3=CC=C(C=C3)F)C(=O)O

InChI

InChI=1S/C20H21FN2O5S/c1-2-28-19(26)13-4-3-9-23(11-13)20(27)22-15-10-16(29-17(15)18(24)25)12-5-7-14(21)8-6-12/h5-8,10,13H,2-4,9,11H2,1H3,(H,22,27)(H,24,25)