methyl 4-[2-fluoranyl-3-[[(4-fluorophenyl)carbamoylamino]methyl]phenyl]piperazine-1-carboxylate

Systemtic Name: methyl 4-[2-fluoranyl-3-[[(4-fluorophenyl)carbamoylamino]methyl]phenyl]piperazine-1-carboxylate Openeye Name: methyl 4-[2-fluoro-3-[[(4-fluorophenyl)carbamoylamino]methyl]phenyl]piperazine-1-carboxylate CAS Name: 4-[2-fluoro-3-[[[(4-fluoroanilino)-oxomethyl]amino]methyl]phenyl]-1-piperazinecarboxylic acid methyl ester IUPAC Name: methyl 4-[2-fluoro-3-[[(4-fluorophenyl)carbamoylamino]methyl]phenyl]piperazine-1-carboxylate Traditional Name: 4-[2-fluoro-3-[[(4-fluorophenyl)carbamoylamino]methyl]phenyl]piperazine-1-carboxylic acid methyl ester Formula: C20H22F2N4O3 MolecularWeight: 404.410486

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)N1CCN(CC1)C2=CC=CC(=C2F)CNC(=O)NC3=CC=C(C=C3)F

Isomeric SMILES

COC(=O)N1CCN(CC1)C2=CC=CC(=C2F)CNC(=O)NC3=CC=C(C=C3)F

InChI

InChI=1S/C20H22F2N4O3/c1-29-20(28)26-11-9-25(10-12-26)17-4-2-3-14(18(17)22)13-23-19(27)24-16-7-5-15(21)6-8-16/h2-8H,9-13H2,1H3,(H2,23,24,27)