ethanedioic acid; 2-methyl-N-[3-(2,3,6-trimethylphenoxy)propyl]propan-2-amine

Systemtic Name: ethanedioic acid; 2-methyl-N-[3-(2,3,6-trimethylphenoxy)propyl]propan-2-amine Openeye Name: 2-methyl-N-[3-(2,3,6-trimethylphenoxy)propyl]propan-2-amine; oxalic acid CAS Name: 2-methyl-N-[3-(2,3,6-trimethylphenoxy)propyl]-2-propanamine; oxalic acid IUPAC Name: 2-methyl-N-[3-(2,3,6-trimethylphenoxy)propyl]propan-2-amine; oxalic acid Traditional Name: tert-butyl-[3-(2,3,6-trimethylphenoxy)propyl]amine; oxalic acid Formula: C18H29NO5 MolecularWeight: 339.42656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C)OCCCNC(C)(C)C)C.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=C(C(=C(C=C1)C)OCCCNC(C)(C)C)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C16H27NO.C2H2O4/c1-12-8-9-13(2)15(14(12)3)18-11-7-10-17-16(4,5)6;3-1(4)2(5)6/h8-9,17H,7,10-11H2,1-6H3;(H,3,4)(H,5,6)