N-[3-(2-tert-butyl-6-methyl-phenoxy)propyl]butan-1-amine; ethanedioic acid

Systemtic Name: N-[3-(2-tert-butyl-6-methyl-phenoxy)propyl]butan-1-amine; ethanedioic acid Openeye Name: N-[3-(2-tert-butyl-6-methyl-phenoxy)propyl]butan-1-amine; oxalic acid CAS Name: N-[3-(2-tert-butyl-6-methylphenoxy)propyl]-1-butanamine; oxalic acid IUPAC Name: N-[3-(2-tert-butyl-6-methylphenoxy)propyl]butan-1-amine; oxalic acid Traditional Name: butyl-[3-(2-tert-butyl-6-methyl-phenoxy)propyl]amine; oxalic acid Formula: C20H33NO5 MolecularWeight: 367.47972

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNCCCOC1=C(C=CC=C1C(C)(C)C)C.C(=O)(C(=O)O)O

Isomeric SMILES

CCCCNCCCOC1=C(C=CC=C1C(C)(C)C)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C18H31NO.C2H2O4/c1-6-7-12-19-13-9-14-20-17-15(2)10-8-11-16(17)18(3,4)5;3-1(4)2(5)6/h8,10-11,19H,6-7,9,12-14H2,1-5H3;(H,3,4)(H,5,6)