3,14-diethylhexadecane-4,13-diamine; terephthalic acid

Systemtic Name: 3,14-diethylhexadecane-4,13-diamine; terephthalic acid Openeye Name: 3,14-diethylhexadecane-4,13-diamine; terephthalic acid CAS Name: 3,14-diethylhexadecane-4,13-diamine; terephthalic acid IUPAC Name: 3,14-diethylhexadecane-4,13-diamine; terephthalic acid Traditional Name: [10-amino-11-ethyl-1-(1-ethylpropyl)tridecyl]amine; terephthalic acid Formula: C28H50N2O4 MolecularWeight: 478.7076

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(CCCCCCCCC(C(CC)CC)N)N.C1=CC(=CC=C1C(=O)O)C(=O)O

Isomeric SMILES

CCC(CC)C(CCCCCCCCC(C(CC)CC)N)N.C1=CC(=CC=C1C(=O)O)C(=O)O

InChI

InChI=1S/C20H44N2.C8H6O4/c1-5-17(6-2)19(21)15-13-11-9-10-12-14-16-20(22)18(7-3)8-4;9-7(10)5-1-2-6(4-3-5)8(11)12/h17-20H,5-16,21-22H2,1-4H3;1-4H,(H,9,10)(H,11,12)