methyl 4-[2-[4-[(5-fluoranyl-2-methoxy-phenyl)methyl]piperazin-1-yl]ethanoylamino]butanoate

Systemtic Name: methyl 4-[2-[4-[(5-fluoranyl-2-methoxy-phenyl)methyl]piperazin-1-yl]ethanoylamino]butanoate Openeye Name: methyl 4-[[2-[4-[(5-fluoro-2-methoxy-phenyl)methyl]piperazin-1-yl]acetyl]amino]butanoate CAS Name: 4-[[2-[4-[(5-fluoro-2-methoxyphenyl)methyl]-1-piperazinyl]-1-oxoethyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-[[2-[4-[(5-fluoro-2-methoxyphenyl)methyl]piperazin-1-yl]acetyl]amino]butanoate Traditional Name: 4-[[2-[4-(5-fluoro-2-methoxy-benzyl)piperazino]acetyl]amino]butyric acid methyl ester Formula: C19H28FN3O4 MolecularWeight: 381.441723

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)F)CN2CCN(CC2)CC(=O)NCCCC(=O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)F)CN2CCN(CC2)CC(=O)NCCCC(=O)OC

InChI

InChI=1S/C19H28FN3O4/c1-26-17-6-5-16(20)12-15(17)13-22-8-10-23(11-9-22)14-18(24)21-7-3-4-19(25)27-2/h5-6,12H,3-4,7-11,13-14H2,1-2H3,(H,21,24)