methyl 4-[[3-fluoranyl-5-[(4-fluorophenyl)carbamoylamino]phenyl]methyl]piperazine-1-carboxylate

Systemtic Name: methyl 4-[[3-fluoranyl-5-[(4-fluorophenyl)carbamoylamino]phenyl]methyl]piperazine-1-carboxylate Openeye Name: methyl 4-[[3-fluoro-5-[(4-fluorophenyl)carbamoylamino]phenyl]methyl]piperazine-1-carboxylate CAS Name: 4-[[3-fluoro-5-[[(4-fluoroanilino)-oxomethyl]amino]phenyl]methyl]-1-piperazinecarboxylic acid methyl ester IUPAC Name: methyl 4-[[3-fluoro-5-[(4-fluorophenyl)carbamoylamino]phenyl]methyl]piperazine-1-carboxylate Traditional Name: 4-[3-fluoro-5-[(4-fluorophenyl)carbamoylamino]benzyl]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)CC2=CC(=CC(=C2)F)NC(=O)NC3=CC=C(C=C3)F

Isomeric SMILES

COC(=O)N1CCN(CC1)CC2=CC(=CC(=C2)F)NC(=O)NC3=CC=C(C=C3)F

InChI

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