methyl 4-[2-[1-[(2-fluoranyl-4-methoxy-phenyl)methyl]-3-oxidanylidene-piperazin-2-yl]ethanoylamino]butanoate

Systemtic Name: methyl 4-[2-[1-[(2-fluoranyl-4-methoxy-phenyl)methyl]-3-oxidanylidene-piperazin-2-yl]ethanoylamino]butanoate Openeye Name: methyl 4-[[2-[1-[(2-fluoro-4-methoxy-phenyl)methyl]-3-oxo-piperazin-2-yl]acetyl]amino]butanoate CAS Name: 4-[[2-[1-[(2-fluoro-4-methoxyphenyl)methyl]-3-oxo-2-piperazinyl]-1-oxoethyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-[[2-[1-[(2-fluoro-4-methoxyphenyl)methyl]-3-oxopiperazin-2-yl]acetyl]amino]butanoate Traditional Name: 4-[[2-[1-(2-fluoro-4-methoxy-benzyl)-3-keto-piperazin-2-yl]acetyl]amino]butyric acid methyl ester Formula: C19H26FN3O5 MolecularWeight: 395.425243

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)CN2CCNC(=O)C2CC(=O)NCCCC(=O)OC)F

Isomeric SMILES

COC1=CC(=C(C=C1)CN2CCNC(=O)C2CC(=O)NCCCC(=O)OC)F

InChI

InChI=1S/C19H26FN3O5/c1-27-14-6-5-13(15(20)10-14)12-23-9-8-22-19(26)16(23)11-17(24)21-7-3-4-18(25)28-2/h5-6,10,16H,3-4,7-9,11-12H2,1-2H3,(H,21,24)(H,22,26)