1-[4-(2-chloranyl-6-prop-2-enyl-phenoxy)butyl]-4-ethyl-piperazine; ethanedioic acid

Systemtic Name: 1-[4-(2-chloranyl-6-prop-2-enyl-phenoxy)butyl]-4-ethyl-piperazine; ethanedioic acid Openeye Name: 1-[4-(2-allyl-6-chloro-phenoxy)butyl]-4-ethyl-piperazine; oxalic acid CAS Name: 1-[4-(2-chloro-6-prop-2-enylphenoxy)butyl]-4-ethylpiperazine; oxalic acid IUPAC Name: 1-[4-(2-chloro-6-prop-2-enylphenoxy)butyl]-4-ethylpiperazine; oxalic acid Traditional Name: 1-[4-(2-allyl-6-chloro-phenoxy)butyl]-4-ethyl-piperazine; oxalic acid Formula: C21H31ClN2O5 MolecularWeight: 426.93424

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)CCCCOC2=C(C=CC=C2Cl)CC=C.C(=O)(C(=O)O)O

Isomeric SMILES

CCN1CCN(CC1)CCCCOC2=C(C=CC=C2Cl)CC=C.C(=O)(C(=O)O)O

InChI

InChI=1S/C19H29ClN2O.C2H2O4/c1-3-8-17-9-7-10-18(20)19(17)23-16-6-5-11-22-14-12-21(4-2)13-15-22;3-1(4)2(5)6/h3,7,9-10H,1,4-6,8,11-16H2,2H3;(H,3,4)(H,5,6)