N-[3-(2,6-dimethylphenoxy)propyl]butan-1-amine; ethanedioic acid

Systemtic Name: N-[3-(2,6-dimethylphenoxy)propyl]butan-1-amine; ethanedioic acid Openeye Name: N-[3-(2,6-dimethylphenoxy)propyl]butan-1-amine; oxalic acid CAS Name: N-[3-(2,6-dimethylphenoxy)propyl]-1-butanamine; oxalic acid IUPAC Name: N-[3-(2,6-dimethylphenoxy)propyl]butan-1-amine; oxalic acid Traditional Name: butyl-[3-(2,6-dimethylphenoxy)propyl]amine; oxalic acid Formula: C17H27NO5 MolecularWeight: 325.39998

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H25NO.C2H2O4/c1-4-5-10-16-11-7-12-17-15-13(2)8-6-9-14(15)3;3-1(4)2(5)6/h6,8-9,16H,4-5,7,10-12H2,1-3H3;(H,3,4)(H,5,6)