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ethanedioic acid; N-[2-(2,3,6-trimethylphenoxy)ethyl]butan-1-amine

ethanedioic acid; N-[2-(2,3,6-trimethylphenoxy)ethyl]butan-1-amine

Systemtic Name:ethanedioic acid; N-[2-(2,3,6-trimethylphenoxy)ethyl]butan-1-amine
Openeye Name:oxalic acid; N-[2-(2,3,6-trimethylphenoxy)ethyl]butan-1-amine
CAS Name:oxalic acid; N-[2-(2,3,6-trimethylphenoxy)ethyl]-1-butanamine
IUPAC Name:oxalic acid; N-[2-(2,3,6-trimethylphenoxy)ethyl]butan-1-amine
Traditional Name:butyl-[2-(2,3,6-trimethylphenoxy)ethyl]amine; oxalic acid
Formula: C17H27NO5
MolecularWeight: 325.39998
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Descriptors Computed from Structure

Canonical SMILES:

CCCCNCCOC1=C(C=CC(=C1C)C)C.C(=O)(C(=O)O)O


Isomeric SMILES

CCCCNCCOC1=C(C=CC(=C1C)C)C.C(=O)(C(=O)O)O


InChI

InChI=1S/C15H25NO.C2H2O4/c1-5-6-9-16-10-11-17-15-13(3)8-7-12(2)14(15)4;3-1(4)2(5)6/h7-8,16H,5-6,9-11H2,1-4H3;(H,3,4)(H,5,6)


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