N-(1-adamantyl)-2-(4-ethylpiperazin-1-yl)ethanamide; ethanedioic acid

Systemtic Name: N-(1-adamantyl)-2-(4-ethylpiperazin-1-yl)ethanamide; ethanedioic acid Openeye Name: N-(1-adamantyl)-2-(4-ethylpiperazin-1-yl)acetamide; oxalic acid CAS Name: N-(1-adamantyl)-2-(4-ethyl-1-piperazinyl)acetamide; oxalic acid IUPAC Name: N-(1-adamantyl)-2-(4-ethylpiperazin-1-yl)acetamide; oxalic acid Traditional Name: N-(1-adamantyl)-2-(4-ethylpiperazino)acetamide; oxalic acid Formula: C22H35N3O9 MolecularWeight: 485.528

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)CC(=O)NC23CC4CC(C2)CC(C4)C3.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O

Isomeric SMILES

CCN1CCN(CC1)CC(=O)NC23CC4CC(C2)CC(C4)C3.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C18H31N3O.2C2H2O4/c1-2-20-3-5-21(6-4-20)13-17(22)19-18-10-14-7-15(11-18)9-16(8-14)12-18;2*3-1(4)2(5)6/h14-16H,2-13H2,1H3,(H,19,22);2*(H,3,4)(H,5,6)