ethyl 4-[1-[(3-fluorophenyl)amino]-1-oxidanylidene-propan-2-yl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[1-[(3-fluorophenyl)amino]-1-oxidanylidene-propan-2-yl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-(3-fluoroanilino)-1-methyl-2-oxo-ethyl]piperazine-1-carboxylate CAS Name: 4-[1-(3-fluoroanilino)-1-oxopropan-2-yl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[1-(3-fluoroanilino)-1-oxopropan-2-yl]piperazine-1-carboxylate Traditional Name: 4-[2-(3-fluoroanilino)-2-keto-1-methyl-ethyl]piperazine-1-carboxylic acid ethyl ester Formula: C16H22FN3O3 MolecularWeight: 323.362583

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(C)C(=O)NC2=CC(=CC=C2)F

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(C)C(=O)NC2=CC(=CC=C2)F

InChI

InChI=1S/C16H22FN3O3/c1-3-23-16(22)20-9-7-19(8-10-20)12(2)15(21)18-14-6-4-5-13(17)11-14/h4-6,11-12H,3,7-10H2,1-2H3,(H,18,21)