N-(2,6-diethylphenyl)-2-(4-ethylpiperazin-1-yl)ethanamide; ethanedioic acid

Systemtic Name: N-(2,6-diethylphenyl)-2-(4-ethylpiperazin-1-yl)ethanamide; ethanedioic acid Openeye Name: N-(2,6-diethylphenyl)-2-(4-ethylpiperazin-1-yl)acetamide; oxalic acid CAS Name: N-(2,6-diethylphenyl)-2-(4-ethyl-1-piperazinyl)acetamide; oxalic acid IUPAC Name: N-(2,6-diethylphenyl)-2-(4-ethylpiperazin-1-yl)acetamide; oxalic acid Traditional Name: N-(2,6-diethylphenyl)-2-(4-ethylpiperazino)acetamide; oxalic acid Formula: C22H33N3O9 MolecularWeight: 483.51212

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=O)CN2CCN(CC2)CC.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=O)CN2CCN(CC2)CC.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C18H29N3O.2C2H2O4/c1-4-15-8-7-9-16(5-2)18(15)19-17(22)14-21-12-10-20(6-3)11-13-21;2*3-1(4)2(5)6/h7-9H,4-6,10-14H2,1-3H3,(H,19,22);2*(H,3,4)(H,5,6)