N-(5-chloranyl-2-phenoxy-phenyl)-2-(4-methylpiperazin-1-yl)ethanamide; ethanedioic acid

Systemtic Name: N-(5-chloranyl-2-phenoxy-phenyl)-2-(4-methylpiperazin-1-yl)ethanamide; ethanedioic acid Openeye Name: N-(5-chloro-2-phenoxy-phenyl)-2-(4-methylpiperazin-1-yl)acetamide; oxalic acid CAS Name: N-(5-chloro-2-phenoxyphenyl)-2-(4-methyl-1-piperazinyl)acetamide; oxalic acid IUPAC Name: N-(5-chloro-2-phenoxyphenyl)-2-(4-methylpiperazin-1-yl)acetamide; oxalic acid Traditional Name: N-(5-chloro-2-phenoxy-phenyl)-2-(4-methylpiperazino)acetamide; oxalic acid Formula: C21H24ClN3O6 MolecularWeight: 449.88476

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CC(=O)NC2=C(C=CC(=C2)Cl)OC3=CC=CC=C3.C(=O)(C(=O)O)O

Isomeric SMILES

CN1CCN(CC1)CC(=O)NC2=C(C=CC(=C2)Cl)OC3=CC=CC=C3.C(=O)(C(=O)O)O

InChI

InChI=1S/C19H22ClN3O2.C2H2O4/c1-22-9-11-23(12-10-22)14-19(24)21-17-13-15(20)7-8-18(17)25-16-5-3-2-4-6-16;3-1(4)2(5)6/h2-8,13H,9-12,14H2,1H3,(H,21,24);(H,3,4)(H,5,6)