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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCNC(=O)CC1C(=O)NCCN1CC2=CC=C(C=C2)F

Isomeric SMILES

CCOC(=O)CCNC(=O)CC1C(=O)NCCN1CC2=CC=C(C=C2)F

InChI

InChI=1S/C18H24FN3O4/c1-2-26-17(24)7-8-20-16(23)11-15-18(25)21-9-10-22(15)12-13-3-5-14(19)6-4-13/h3-6,15H,2,7-12H2,1H3,(H,20,23)(H,21,25)