methyl 4-[2-[1-[(3-fluorophenyl)methyl]-3-oxidanylidene-piperazin-2-yl]ethanoylamino]butanoate

Systemtic Name: methyl 4-[2-[1-[(3-fluorophenyl)methyl]-3-oxidanylidene-piperazin-2-yl]ethanoylamino]butanoate Openeye Name: methyl 4-[[2-[1-[(3-fluorophenyl)methyl]-3-oxo-piperazin-2-yl]acetyl]amino]butanoate CAS Name: 4-[[2-[1-[(3-fluorophenyl)methyl]-3-oxo-2-piperazinyl]-1-oxoethyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-[[2-[1-[(3-fluorophenyl)methyl]-3-oxopiperazin-2-yl]acetyl]amino]butanoate Traditional Name: 4-[[2-[1-(3-fluorobenzyl)-3-keto-piperazin-2-yl]acetyl]amino]butyric acid methyl ester Formula: C18H24FN3O4 MolecularWeight: 365.399263

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCNC(=O)CC1C(=O)NCCN1CC2=CC(=CC=C2)F

Isomeric SMILES

COC(=O)CCCNC(=O)CC1C(=O)NCCN1CC2=CC(=CC=C2)F

InChI

InChI=1S/C18H24FN3O4/c1-26-17(24)6-3-7-20-16(23)11-15-18(25)21-8-9-22(15)12-13-4-2-5-14(19)10-13/h2,4-5,10,15H,3,6-9,11-12H2,1H3,(H,20,23)(H,21,25)