methyl 3-[2-[4-[(4-fluorophenyl)carbonylamino]piperidin-1-yl]ethanoylamino]-4-methyl-benzoate

Systemtic Name: methyl 3-[2-[4-[(4-fluorophenyl)carbonylamino]piperidin-1-yl]ethanoylamino]-4-methyl-benzoate Openeye Name: methyl 3-[[2-[4-[(4-fluorobenzoyl)amino]-1-piperidyl]acetyl]amino]-4-methyl-benzoate CAS Name: 3-[[2-[4-[[(4-fluorophenyl)-oxomethyl]amino]-1-piperidinyl]-1-oxoethyl]amino]-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[[2-[4-[(4-fluorobenzoyl)amino]piperidin-1-yl]acetyl]amino]-4-methylbenzoate Traditional Name: 3-[[2-[4-[(4-fluorobenzoyl)amino]piperidino]acetyl]amino]-4-methyl-benzoic acid methyl ester Formula: C23H26FN3O4 MolecularWeight: 427.468643

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CN2CCC(CC2)NC(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CN2CCC(CC2)NC(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C23H26FN3O4/c1-15-3-4-17(23(30)31-2)13-20(15)26-21(28)14-27-11-9-19(10-12-27)25-22(29)16-5-7-18(24)8-6-16/h3-8,13,19H,9-12,14H2,1-2H3,(H,25,29)(H,26,28)