methyl 2-[[5-[4-(4-fluorophenyl)piperazin-1-yl]-5-oxidanylidene-pentanoyl]amino]ethanoate

Systemtic Name: methyl 2-[[5-[4-(4-fluorophenyl)piperazin-1-yl]-5-oxidanylidene-pentanoyl]amino]ethanoate Openeye Name: methyl 2-[[5-[4-(4-fluorophenyl)piperazin-1-yl]-5-oxo-pentanoyl]amino]acetate CAS Name: 2-[[5-[4-(4-fluorophenyl)-1-piperazinyl]-1,5-dioxopentyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[5-[4-(4-fluorophenyl)piperazin-1-yl]-5-oxopentanoyl]amino]acetate Traditional Name: 2-[[5-[4-(4-fluorophenyl)piperazino]-5-keto-pentanoyl]amino]acetic acid methyl ester Formula: C18H24FN3O4 MolecularWeight: 365.399263

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CNC(=O)CCCC(=O)N1CCN(CC1)C2=CC=C(C=C2)F

Isomeric SMILES

COC(=O)CNC(=O)CCCC(=O)N1CCN(CC1)C2=CC=C(C=C2)F

InChI

InChI=1S/C18H24FN3O4/c1-26-18(25)13-20-16(23)3-2-4-17(24)22-11-9-21(10-12-22)15-7-5-14(19)6-8-15/h5-8H,2-4,9-13H2,1H3,(H,20,23)