1-[2-(4-chloranyl-2-prop-2-enyl-phenoxy)ethyl]-3,5-dimethyl-piperidine; ethanedioic acid

Systemtic Name: 1-[2-(4-chloranyl-2-prop-2-enyl-phenoxy)ethyl]-3,5-dimethyl-piperidine; ethanedioic acid Openeye Name: 1-[2-(2-allyl-4-chloro-phenoxy)ethyl]-3,5-dimethyl-piperidine; oxalic acid CAS Name: 1-[2-(4-chloro-2-prop-2-enylphenoxy)ethyl]-3,5-dimethylpiperidine; oxalic acid IUPAC Name: 1-[2-(4-chloro-2-prop-2-enylphenoxy)ethyl]-3,5-dimethylpiperidine; oxalic acid Traditional Name: 1-[2-(2-allyl-4-chloro-phenoxy)ethyl]-3,5-dimethyl-piperidine; oxalic acid Formula: C20H28ClNO5 MolecularWeight: 397.89302

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)CCOC2=C(C=C(C=C2)Cl)CC=C)C.C(=O)(C(=O)O)O

Isomeric SMILES

CC1CC(CN(C1)CCOC2=C(C=C(C=C2)Cl)CC=C)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C18H26ClNO.C2H2O4/c1-4-5-16-11-17(19)6-7-18(16)21-9-8-20-12-14(2)10-15(3)13-20;3-1(4)2(5)6/h4,6-7,11,14-15H,1,5,8-10,12-13H2,2-3H3;(H,3,4)(H,5,6)