4-(2-bromanyl-4-methyl-phenoxy)-N-butyl-butan-1-amine; ethanedioic acid

Systemtic Name: 4-(2-bromanyl-4-methyl-phenoxy)-N-butyl-butan-1-amine; ethanedioic acid Openeye Name: 4-(2-bromo-4-methyl-phenoxy)-N-butyl-butan-1-amine; oxalic acid CAS Name: 4-(2-bromo-4-methylphenoxy)-N-butyl-1-butanamine; oxalic acid IUPAC Name: 4-(2-bromo-4-methylphenoxy)-N-butylbutan-1-amine; oxalic acid Traditional Name: 4-(2-bromo-4-methyl-phenoxy)butyl-butyl-amine; oxalic acid Formula: C17H26BrNO5 MolecularWeight: 404.29604

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNCCCCOC1=C(C=C(C=C1)C)Br.C(=O)(C(=O)O)O

Isomeric SMILES

CCCCNCCCCOC1=C(C=C(C=C1)C)Br.C(=O)(C(=O)O)O

InChI

InChI=1S/C15H24BrNO.C2H2O4/c1-3-4-9-17-10-5-6-11-18-15-8-7-13(2)12-14(15)16;3-1(4)2(5)6/h7-8,12,17H,3-6,9-11H2,1-2H3;(H,3,4)(H,5,6)