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ethanedioic acid; 1-[3-(2,3,6-trimethylphenoxy)propyl]piperidine

ethanedioic acid; 1-[3-(2,3,6-trimethylphenoxy)propyl]piperidine

Systemtic Name:ethanedioic acid; 1-[3-(2,3,6-trimethylphenoxy)propyl]piperidine
Openeye Name:oxalic acid; 1-[3-(2,3,6-trimethylphenoxy)propyl]piperidine
CAS Name:oxalic acid; 1-[3-(2,3,6-trimethylphenoxy)propyl]piperidine
IUPAC Name:oxalic acid; 1-[3-(2,3,6-trimethylphenoxy)propyl]piperidine
Traditional Name:oxalic acid; 1-[3-(2,3,6-trimethylphenoxy)propyl]piperidine
Formula: C19H29NO5
MolecularWeight: 351.43726
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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C)OCCCN2CCCCC2)C.C(=O)(C(=O)O)O


Isomeric SMILES

CC1=C(C(=C(C=C1)C)OCCCN2CCCCC2)C.C(=O)(C(=O)O)O


InChI

InChI=1S/C17H27NO.C2H2O4/c1-14-8-9-15(2)17(16(14)3)19-13-7-12-18-10-5-4-6-11-18;3-1(4)2(5)6/h8-9H,4-7,10-13H2,1-3H3;(H,3,4)(H,5,6)


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