methyl 3-[[1-(4-fluorophenyl)carbonylpiperidin-4-yl]carbonylamino]-4-methyl-benzoate

Systemtic Name: methyl 3-[[1-(4-fluorophenyl)carbonylpiperidin-4-yl]carbonylamino]-4-methyl-benzoate Openeye Name: methyl 3-[[1-(4-fluorobenzoyl)piperidine-4-carbonyl]amino]-4-methyl-benzoate CAS Name: 3-[[[1-[(4-fluorophenyl)-oxomethyl]-4-piperidinyl]-oxomethyl]amino]-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[[1-(4-fluorobenzoyl)piperidine-4-carbonyl]amino]-4-methylbenzoate Traditional Name: 3-[[1-(4-fluorobenzoyl)isonipecotoyl]amino]-4-methyl-benzoic acid methyl ester Formula: C22H23FN2O4 MolecularWeight: 398.427423

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)C2CCN(CC2)C(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)C2CCN(CC2)C(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C22H23FN2O4/c1-14-3-4-17(22(28)29-2)13-19(14)24-20(26)15-9-11-25(12-10-15)21(27)16-5-7-18(23)8-6-16/h3-8,13,15H,9-12H2,1-2H3,(H,24,26)