1-[5-[2-(phenethylamino)pentyl]-2-phenylmethoxy-phenyl]urea hydrobromide

Systemtic Name: 1-[5-[2-(phenethylamino)pentyl]-2-phenylmethoxy-phenyl]urea hydrobromide Openeye Name: [2-benzyloxy-5-[2-(phenethylamino)pentyl]phenyl]urea hydrobromide CAS Name: [5-[2-(phenethylamino)pentyl]-2-phenylmethoxyphenyl]urea hydrobromide IUPAC Name: [5-[2-(phenethylamino)pentyl]-2-phenylmethoxyphenyl]urea hydrobromide Traditional Name: [2-benzoxy-5-[2-(phenethylamino)pentyl]phenyl]urea hydrobromide Formula: C27H34BrN3O2 MolecularWeight: 512.48176

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CC1=CC(=C(C=C1)OCC2=CC=CC=C2)NC(=O)N)NCCC3=CC=CC=C3.Br

Isomeric SMILES

CCCC(CC1=CC(=C(C=C1)OCC2=CC=CC=C2)NC(=O)N)NCCC3=CC=CC=C3.Br

InChI

InChI=1S/C27H33N3O2.BrH/c1-2-9-24(29-17-16-21-10-5-3-6-11-21)18-23-14-15-26(25(19-23)30-27(28)31)32-20-22-12-7-4-8-13-22;/h3-8,10-15,19,24,29H,2,9,16-18,20H2,1H3,(H3,28,30,31);1H