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

Systemtic Name: methyl 4-[2-[1-(furan-3-ylmethyl)-3-oxidanylidene-piperazin-2-yl]ethanoylamino]butanoate Openeye Name: methyl 4-[[2-[1-(3-furylmethyl)-3-oxo-piperazin-2-yl]acetyl]amino]butanoate CAS Name: 4-[[2-[1-(3-furanylmethyl)-3-oxo-2-piperazinyl]-1-oxoethyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-[[2-[1-(furan-3-ylmethyl)-3-oxopiperazin-2-yl]acetyl]amino]butanoate Traditional Name: 4-[[2-[1-(3-furfuryl)-3-keto-piperazin-2-yl]acetyl]amino]butyric acid methyl ester Formula: C16H23N3O5 MolecularWeight: 337.37092

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23N3O5/c1-23-15(21)3-2-5-17-14(20)9-13-16(22)18-6-7-19(13)10-12-4-8-24-11-12/h4,8,11,13H,2-3,5-7,9-10H2,1H3,(H,17,20)(H,18,22)