O4-[2-(4-ethanoylpiperazin-1-yl)-2-oxidanylidene-ethyl] O1-methyl (E)-but-2-enedioate

Systemtic Name: O4-[2-(4-ethanoylpiperazin-1-yl)-2-oxidanylidene-ethyl] O1-methyl (E)-but-2-enedioate Openeye Name: O4-[2-(4-acetylpiperazin-1-yl)-2-oxo-ethyl] O1-methyl (E)-but-2-enedioate CAS Name: (E)-2-butenedioic acid O4-[2-(4-acetyl-1-piperazinyl)-2-oxoethyl] ester O1-methyl ester IUPAC Name: 4-O-[2-(4-acetylpiperazin-1-yl)-2-oxoethyl] 1-O-methyl (E)-but-2-enedioate Traditional Name: (E)-but-2-enedioic acid O4-[2-(4-acetylpiperazino)-2-keto-ethyl] ester O1-methyl ester Formula: C13H18N2O6 MolecularWeight: 298.29182

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C(=O)COC(=O)C=CC(=O)OC

Isomeric SMILES

CC(=O)N1CCN(CC1)C(=O)COC(=O)/C=C/C(=O)OC

InChI

InChI=1S/C13H18N2O6/c1-10(16)14-5-7-15(8-6-14)11(17)9-21-13(19)4-3-12(18)20-2/h3-4H,5-9H2,1-2H3/b4-3+