N-[3-(3-bromanylphenoxy)propyl]cyclopentanamine; ethanedioic acid

Systemtic Name: N-[3-(3-bromanylphenoxy)propyl]cyclopentanamine; ethanedioic acid Openeye Name: N-[3-(3-bromophenoxy)propyl]cyclopentanamine; oxalic acid CAS Name: N-[3-(3-bromophenoxy)propyl]cyclopentanamine; oxalic acid IUPAC Name: N-[3-(3-bromophenoxy)propyl]cyclopentanamine; oxalic acid Traditional Name: 3-(3-bromophenoxy)propyl-cyclopentyl-amine; oxalic acid Formula: C16H22BrNO5 MolecularWeight: 388.25358

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NCCCOC2=CC(=CC=C2)Br.C(=O)(C(=O)O)O

Isomeric SMILES

C1CCC(C1)NCCCOC2=CC(=CC=C2)Br.C(=O)(C(=O)O)O

InChI

InChI=1S/C14H20BrNO.C2H2O4/c15-12-5-3-8-14(11-12)17-10-4-9-16-13-6-1-2-7-13;3-1(4)2(5)6/h3,5,8,11,13,16H,1-2,4,6-7,9-10H2;(H,3,4)(H,5,6)