dimethyl 5-[2-[4-(oxolan-2-ylcarbonyl)piperazin-1-yl]ethanoylamino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[2-[4-(oxolan-2-ylcarbonyl)piperazin-1-yl]ethanoylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[[2-[4-(tetrahydrofuran-2-carbonyl)piperazin-1-yl]acetyl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[1-oxo-2-[4-[oxo(2-oxolanyl)methyl]-1-piperazinyl]ethyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[2-[4-(oxolane-2-carbonyl)piperazin-1-yl]acetyl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[2-[4-(tetrahydrofuran-2-carbonyl)piperazino]acetyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C21H27N3O7 MolecularWeight: 433.45498

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)NC(=O)CN2CCN(CC2)C(=O)C3CCCO3)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)NC(=O)CN2CCN(CC2)C(=O)C3CCCO3)C(=O)OC

InChI

InChI=1S/C21H27N3O7/c1-29-20(27)14-10-15(21(28)30-2)12-16(11-14)22-18(25)13-23-5-7-24(8-6-23)19(26)17-4-3-9-31-17/h10-12,17H,3-9,13H2,1-2H3,(H,22,25)