ethanedioic acid; 2-[4-(oxolan-2-ylmethyl)piperazin-1-yl]-N-(2-phenoxyphenyl)ethanamide

Systemtic Name: ethanedioic acid; 2-[4-(oxolan-2-ylmethyl)piperazin-1-yl]-N-(2-phenoxyphenyl)ethanamide Openeye Name: oxalic acid; N-(2-phenoxyphenyl)-2-[4-(tetrahydrofuran-2-ylmethyl)piperazin-1-yl]acetamide CAS Name: oxalic acid; 2-[4-(2-oxolanylmethyl)-1-piperazinyl]-N-(2-phenoxyphenyl)acetamide IUPAC Name: oxalic acid; 2-[4-(oxolan-2-ylmethyl)piperazin-1-yl]-N-(2-phenoxyphenyl)acetamide Traditional Name: oxalic acid; N-(2-phenoxyphenyl)-2-[4-(tetrahydrofurfuryl)piperazino]acetamide Formula: C27H33N3O11 MolecularWeight: 575.56442

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN2CCN(CC2)CC(=O)NC3=CC=CC=C3OC4=CC=CC=C4.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O

Isomeric SMILES

C1CC(OC1)CN2CCN(CC2)CC(=O)NC3=CC=CC=C3OC4=CC=CC=C4.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C23H29N3O3.2C2H2O4/c27-23(18-26-14-12-25(13-15-26)17-20-9-6-16-28-20)24-21-10-4-5-11-22(21)29-19-7-2-1-3-8-19;2*3-1(4)2(5)6/h1-5,7-8,10-11,20H,6,9,12-18H2,(H,24,27);2*(H,3,4)(H,5,6)