1-[4-(4-chloranylphenoxy)but-2-ynyl]-4-methyl-piperazine; ethanedioic acid

Systemtic Name: 1-[4-(4-chloranylphenoxy)but-2-ynyl]-4-methyl-piperazine; ethanedioic acid Openeye Name: 1-[4-(4-chlorophenoxy)but-2-ynyl]-4-methyl-piperazine; oxalic acid CAS Name: 1-[4-(4-chlorophenoxy)but-2-ynyl]-4-methylpiperazine; oxalic acid IUPAC Name: 1-[4-(4-chlorophenoxy)but-2-ynyl]-4-methylpiperazine; oxalic acid Traditional Name: 1-[4-(4-chlorophenoxy)but-2-ynyl]-4-methyl-piperazine; oxalic acid Formula: C17H21ClN2O5 MolecularWeight: 368.81204

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CC#CCOC2=CC=C(C=C2)Cl.C(=O)(C(=O)O)O

Isomeric SMILES

CN1CCN(CC1)CC#CCOC2=CC=C(C=C2)Cl.C(=O)(C(=O)O)O

InChI

InChI=1S/C15H19ClN2O.C2H2O4/c1-17-9-11-18(12-10-17)8-2-3-13-19-15-6-4-14(16)5-7-15;3-1(4)2(5)6/h4-7H,8-13H2,1H3;(H,3,4)(H,5,6)