1-[3-(4-chloranyl-3-ethyl-phenoxy)propyl]-3-methyl-piperidine; ethanedioic acid

Systemtic Name: 1-[3-(4-chloranyl-3-ethyl-phenoxy)propyl]-3-methyl-piperidine; ethanedioic acid Openeye Name: 1-[3-(4-chloro-3-ethyl-phenoxy)propyl]-3-methyl-piperidine; oxalic acid CAS Name: 1-[3-(4-chloro-3-ethylphenoxy)propyl]-3-methylpiperidine; oxalic acid IUPAC Name: 1-[3-(4-chloro-3-ethylphenoxy)propyl]-3-methylpiperidine; oxalic acid Traditional Name: 1-[3-(4-chloro-3-ethyl-phenoxy)propyl]-3-methyl-piperidine; oxalic acid Formula: C19H28ClNO5 MolecularWeight: 385.88232

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)OCCCN2CCCC(C2)C)Cl.C(=O)(C(=O)O)O

Isomeric SMILES

CCC1=C(C=CC(=C1)OCCCN2CCCC(C2)C)Cl.C(=O)(C(=O)O)O

InChI

InChI=1S/C17H26ClNO.C2H2O4/c1-3-15-12-16(7-8-17(15)18)20-11-5-10-19-9-4-6-14(2)13-19;3-1(4)2(5)6/h7-8,12,14H,3-6,9-11,13H2,1-2H3;(H,3,4)(H,5,6)