N-[3-(4-bromanyl-2-chloranyl-phenoxy)propyl]-3-methoxy-propan-1-amine; ethanedioic acid

Systemtic Name: N-[3-(4-bromanyl-2-chloranyl-phenoxy)propyl]-3-methoxy-propan-1-amine; ethanedioic acid Openeye Name: N-[3-(4-bromo-2-chloro-phenoxy)propyl]-3-methoxy-propan-1-amine; oxalic acid CAS Name: N-[3-(4-bromo-2-chlorophenoxy)propyl]-3-methoxy-1-propanamine; oxalic acid IUPAC Name: N-[3-(4-bromo-2-chlorophenoxy)propyl]-3-methoxypropan-1-amine; oxalic acid Traditional Name: 3-(4-bromo-2-chloro-phenoxy)propyl-(3-methoxypropyl)amine; oxalic acid Formula: C15H21BrClNO6 MolecularWeight: 426.68734

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNCCCOC1=C(C=C(C=C1)Br)Cl.C(=O)(C(=O)O)O

Isomeric SMILES

COCCCNCCCOC1=C(C=C(C=C1)Br)Cl.C(=O)(C(=O)O)O

InChI

InChI=1S/C13H19BrClNO2.C2H2O4/c1-17-8-2-6-16-7-3-9-18-13-5-4-11(14)10-12(13)15;3-1(4)2(5)6/h4-5,10,16H,2-3,6-9H2,1H3;(H,3,4)(H,5,6)