ethanedioic acid; N-[2-(2,3,5-trimethylphenoxy)ethyl]butan-2-amine

Systemtic Name: ethanedioic acid; N-[2-(2,3,5-trimethylphenoxy)ethyl]butan-2-amine Openeye Name: oxalic acid; N-[2-(2,3,5-trimethylphenoxy)ethyl]butan-2-amine CAS Name: oxalic acid; N-[2-(2,3,5-trimethylphenoxy)ethyl]-2-butanamine IUPAC Name: oxalic acid; N-[2-(2,3,5-trimethylphenoxy)ethyl]butan-2-amine Traditional Name: oxalic acid; sec-butyl-[2-(2,3,5-trimethylphenoxy)ethyl]amine Formula: C17H27NO5 MolecularWeight: 325.39998

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NCCOC1=CC(=CC(=C1C)C)C.C(=O)(C(=O)O)O

Isomeric SMILES

CCC(C)NCCOC1=CC(=CC(=C1C)C)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C15H25NO.C2H2O4/c1-6-13(4)16-7-8-17-15-10-11(2)9-12(3)14(15)5;3-1(4)2(5)6/h9-10,13,16H,6-8H2,1-5H3;(H,3,4)(H,5,6)