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N,N-diethyl-N'-octyl-N'-pyridin-2-yl-ethane-1,2-diamine; ethanedioic acid

N,N-diethyl-N'-octyl-N'-pyridin-2-yl-ethane-1,2-diamine; ethanedioic acid

Systemtic Name:N,N-diethyl-N'-octyl-N'-pyridin-2-yl-ethane-1,2-diamine; ethanedioic acid
Openeye Name:N,N-diethyl-N'-octyl-N'-(2-pyridyl)ethane-1,2-diamine; oxalic acid
CAS Name:N,N-diethyl-N'-octyl-N'-(2-pyridinyl)ethane-1,2-diamine; oxalic acid
IUPAC Name:N,N-diethyl-N'-octyl-N'-pyridin-2-ylethane-1,2-diamine; oxalic acid
Traditional Name:diethyl-[2-[octyl(2-pyridyl)amino]ethyl]amine; oxalic acid
Formula: C25H41N3O12
MolecularWeight: 575.60594
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN(CCN(CC)CC)C1=CC=CC=N1.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O


Isomeric SMILES

CCCCCCCCN(CCN(CC)CC)C1=CC=CC=N1.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O


InChI

InChI=1S/C19H35N3.3C2H2O4/c1-4-7-8-9-10-13-16-22(18-17-21(5-2)6-3)19-14-11-12-15-20-19;3*3-1(4)2(5)6/h11-12,14-15H,4-10,13,16-18H2,1-3H3;3*(H,3,4)(H,5,6)


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