[2-(butan-2-ylamino)-2-oxidanylidene-ethyl] 2-[(2-fluorophenyl)amino]pyridine-3-carboxylate

Systemtic Name: [2-(butan-2-ylamino)-2-oxidanylidene-ethyl] 2-[(2-fluorophenyl)amino]pyridine-3-carboxylate Openeye Name: [2-oxo-2-(sec-butylamino)ethyl] 2-(2-fluoroanilino)pyridine-3-carboxylate CAS Name: 2-(2-fluoroanilino)-3-pyridinecarboxylic acid [2-(butan-2-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(butan-2-ylamino)-2-oxoethyl] 2-(2-fluoroanilino)pyridine-3-carboxylate Traditional Name: 2-(2-fluoroanilino)nicotinic acid [2-keto-2-(sec-butylamino)ethyl] ester Formula: C18H20FN3O3 MolecularWeight: 345.368103

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)COC(=O)C1=C(N=CC=C1)NC2=CC=CC=C2F

Isomeric SMILES

CCC(C)NC(=O)COC(=O)C1=C(N=CC=C1)NC2=CC=CC=C2F

InChI

InChI=1S/C18H20FN3O3/c1-3-12(2)21-16(23)11-25-18(24)13-7-6-10-20-17(13)22-15-9-5-4-8-14(15)19/h4-10,12H,3,11H2,1-2H3,(H,20,22)(H,21,23)