ethanedioic acid; N-(furan-2-ylmethyl)-6-(2,3,5-trimethylphenoxy)hexan-1-amine

Systemtic Name: ethanedioic acid; N-(furan-2-ylmethyl)-6-(2,3,5-trimethylphenoxy)hexan-1-amine Openeye Name: N-(2-furylmethyl)-6-(2,3,5-trimethylphenoxy)hexan-1-amine; oxalic acid CAS Name: N-(2-furanylmethyl)-6-(2,3,5-trimethylphenoxy)-1-hexanamine; oxalic acid IUPAC Name: N-(furan-2-ylmethyl)-6-(2,3,5-trimethylphenoxy)hexan-1-amine; oxalic acid Traditional Name: 2-furfuryl-[6-(2,3,5-trimethylphenoxy)hexyl]amine; oxalic acid Formula: C22H31NO6 MolecularWeight: 405.48464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)OCCCCCCNCC2=CC=CO2)C)C.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=CC(=C(C(=C1)OCCCCCCNCC2=CC=CO2)C)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C20H29NO2.C2H2O4/c1-16-13-17(2)18(3)20(14-16)23-11-7-5-4-6-10-21-15-19-9-8-12-22-19;3-1(4)2(5)6/h8-9,12-14,21H,4-7,10-11,15H2,1-3H3;(H,3,4)(H,5,6)