1-(4-butan-2-ylpiperazin-1-yl)-2-(4-chloranylphenoxy)ethanone; ethanedioic acid

Systemtic Name: 1-(4-butan-2-ylpiperazin-1-yl)-2-(4-chloranylphenoxy)ethanone; ethanedioic acid Openeye Name: 2-(4-chlorophenoxy)-1-(4-sec-butylpiperazin-1-yl)ethanone; oxalic acid CAS Name: 1-(4-butan-2-yl-1-piperazinyl)-2-(4-chlorophenoxy)ethanone; oxalic acid IUPAC Name: 1-(4-butan-2-ylpiperazin-1-yl)-2-(4-chlorophenoxy)ethanone; oxalic acid Traditional Name: 2-(4-chlorophenoxy)-1-(4-sec-butylpiperazino)ethanone; oxalic acid Formula: C18H25ClN2O6 MolecularWeight: 400.8539

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1CCN(CC1)C(=O)COC2=CC=C(C=C2)Cl.C(=O)(C(=O)O)O

Isomeric SMILES

CCC(C)N1CCN(CC1)C(=O)COC2=CC=C(C=C2)Cl.C(=O)(C(=O)O)O

InChI

InChI=1S/C16H23ClN2O2.C2H2O4/c1-3-13(2)18-8-10-19(11-9-18)16(20)12-21-15-6-4-14(17)5-7-15;3-1(4)2(5)6/h4-7,13H,3,8-12H2,1-2H3;(H,3,4)(H,5,6)