ethyl 4-(4-ethanoylpiperazin-1-yl)-3-[(3-fluorophenyl)carbonylamino]benzoate

Systemtic Name: ethyl 4-(4-ethanoylpiperazin-1-yl)-3-[(3-fluorophenyl)carbonylamino]benzoate Openeye Name: ethyl 4-(4-acetylpiperazin-1-yl)-3-[(3-fluorobenzoyl)amino]benzoate CAS Name: 4-(4-acetyl-1-piperazinyl)-3-[[(3-fluorophenyl)-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-(4-acetylpiperazin-1-yl)-3-[(3-fluorobenzoyl)amino]benzoate Traditional Name: 4-(4-acetylpiperazino)-3-[(3-fluorobenzoyl)amino]benzoic acid ethyl ester Formula: C22H24FN3O4 MolecularWeight: 413.442063

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)C)NC(=O)C3=CC(=CC=C3)F

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)C)NC(=O)C3=CC(=CC=C3)F

InChI

InChI=1S/C22H24FN3O4/c1-3-30-22(29)17-7-8-20(26-11-9-25(10-12-26)15(2)27)19(14-17)24-21(28)16-5-4-6-18(23)13-16/h4-8,13-14H,3,9-12H2,1-2H3,(H,24,28)