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

Systemtic Name: dimethyl 5-[[4-(oxolan-2-ylcarbonyl)piperazin-1-yl]carbonylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[[4-(tetrahydrofuran-2-carbonyl)piperazine-1-carbonyl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[oxo-[4-[oxo(2-oxolanyl)methyl]-1-piperazinyl]methyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[4-(oxolane-2-carbonyl)piperazine-1-carbonyl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[4-(tetrahydrofuran-2-carbonyl)piperazine-1-carbonyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C20H25N3O7 MolecularWeight: 419.4284

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)NC(=O)N2CCN(CC2)C(=O)C3CCCO3)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)NC(=O)N2CCN(CC2)C(=O)C3CCCO3)C(=O)OC

InChI

InChI=1S/C20H25N3O7/c1-28-18(25)13-10-14(19(26)29-2)12-15(11-13)21-20(27)23-7-5-22(6-8-23)17(24)16-4-3-9-30-16/h10-12,16H,3-9H2,1-2H3,(H,21,27)