ethanedioic acid; N'-[2-(3-methyl-4-propan-2-yl-phenoxy)ethyl]ethane-1,2-diamine

Systemtic Name: ethanedioic acid; N'-[2-(3-methyl-4-propan-2-yl-phenoxy)ethyl]ethane-1,2-diamine Openeye Name: N'-[2-(4-isopropyl-3-methyl-phenoxy)ethyl]ethane-1,2-diamine; oxalic acid CAS Name: N'-[2-(3-methyl-4-propan-2-ylphenoxy)ethyl]ethane-1,2-diamine; oxalic acid IUPAC Name: N'-[2-(3-methyl-4-propan-2-ylphenoxy)ethyl]ethane-1,2-diamine; oxalic acid Traditional Name: 2-aminoethyl-[2-(4-isopropyl-3-methyl-phenoxy)ethyl]amine; oxalic acid Formula: C16H26N2O5 MolecularWeight: 326.38804

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCCNCCN)C(C)C.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=C(C=CC(=C1)OCCNCCN)C(C)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C14H24N2O.C2H2O4/c1-11(2)14-5-4-13(10-12(14)3)17-9-8-16-7-6-15;3-1(4)2(5)6/h4-5,10-11,16H,6-9,15H2,1-3H3;(H,3,4)(H,5,6)