methyl 2-[4-(3-fluorophenyl)carbonyl-2-oxidanylidene-3-(2-oxidanyl-3-phenoxy-propyl)piperazin-1-yl]ethanoate

Systemtic Name: methyl 2-[4-(3-fluorophenyl)carbonyl-2-oxidanylidene-3-(2-oxidanyl-3-phenoxy-propyl)piperazin-1-yl]ethanoate Openeye Name: methyl 2-[4-(3-fluorobenzoyl)-3-(2-hydroxy-3-phenoxy-propyl)-2-oxo-piperazin-1-yl]acetate CAS Name: 2-[4-[(3-fluorophenyl)-oxomethyl]-3-(2-hydroxy-3-phenoxypropyl)-2-oxo-1-piperazinyl]acetic acid methyl ester IUPAC Name: methyl 2-[4-(3-fluorobenzoyl)-3-(2-hydroxy-3-phenoxypropyl)-2-oxopiperazin-1-yl]acetate Traditional Name: 2-[4-(3-fluorobenzoyl)-3-(2-hydroxy-3-phenoxy-propyl)-2-keto-piperazino]acetic acid methyl ester Formula: C23H25FN2O6 MolecularWeight: 444.452803

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1CCN(C(C1=O)CC(COC2=CC=CC=C2)O)C(=O)C3=CC(=CC=C3)F

Isomeric SMILES

COC(=O)CN1CCN(C(C1=O)CC(COC2=CC=CC=C2)O)C(=O)C3=CC(=CC=C3)F

InChI

InChI=1S/C23H25FN2O6/c1-31-21(28)14-25-10-11-26(22(29)16-6-5-7-17(24)12-16)20(23(25)30)13-18(27)15-32-19-8-3-2-4-9-19/h2-9,12,18,20,27H,10-11,13-15H2,1H3