N-[3-(4-bromanyl-2-chloranyl-phenoxy)propyl]-2-methyl-propan-2-amine; ethanedioic acid

Systemtic Name: N-[3-(4-bromanyl-2-chloranyl-phenoxy)propyl]-2-methyl-propan-2-amine; ethanedioic acid Openeye Name: N-[3-(4-bromo-2-chloro-phenoxy)propyl]-2-methyl-propan-2-amine; oxalic acid CAS Name: N-[3-(4-bromo-2-chlorophenoxy)propyl]-2-methyl-2-propanamine; oxalic acid IUPAC Name: N-[3-(4-bromo-2-chlorophenoxy)propyl]-2-methylpropan-2-amine; oxalic acid Traditional Name: 3-(4-bromo-2-chloro-phenoxy)propyl-tert-butyl-amine; oxalic acid Formula: C15H21BrClNO5 MolecularWeight: 410.68794

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NCCCOC1=C(C=C(C=C1)Br)Cl.C(=O)(C(=O)O)O

Isomeric SMILES

CC(C)(C)NCCCOC1=C(C=C(C=C1)Br)Cl.C(=O)(C(=O)O)O

InChI

InChI=1S/C13H19BrClNO.C2H2O4/c1-13(2,3)16-7-4-8-17-12-6-5-10(14)9-11(12)15;3-1(4)2(5)6/h5-6,9,16H,4,7-8H2,1-3H3;(H,3,4)(H,5,6)