N-butyl-4-(2,6-dimethylphenoxy)butan-1-amine; ethanedioic acid

Systemtic Name: N-butyl-4-(2,6-dimethylphenoxy)butan-1-amine; ethanedioic acid Openeye Name: N-butyl-4-(2,6-dimethylphenoxy)butan-1-amine; oxalic acid CAS Name: N-butyl-4-(2,6-dimethylphenoxy)-1-butanamine; oxalic acid IUPAC Name: N-butyl-4-(2,6-dimethylphenoxy)butan-1-amine; oxalic acid Traditional Name: butyl-[4-(2,6-dimethylphenoxy)butyl]amine; oxalic acid Formula: C18H29NO5 MolecularWeight: 339.42656

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNCCCCOC1=C(C=CC=C1C)C.C(=O)(C(=O)O)O

Isomeric SMILES

CCCCNCCCCOC1=C(C=CC=C1C)C.C(=O)(C(=O)O)O

InChI

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