1-[5-[2-[2-(3-methoxyphenyl)ethylamino]pentyl]-2-phenylmethoxy-phenyl]urea hydrobromide

Systemtic Name: 1-[5-[2-[2-(3-methoxyphenyl)ethylamino]pentyl]-2-phenylmethoxy-phenyl]urea hydrobromide Openeye Name: [2-benzyloxy-5-[2-[2-(3-methoxyphenyl)ethylamino]pentyl]phenyl]urea hydrobromide CAS Name: [5-[2-[2-(3-methoxyphenyl)ethylamino]pentyl]-2-phenylmethoxyphenyl]urea hydrobromide IUPAC Name: [5-[2-[2-(3-methoxyphenyl)ethylamino]pentyl]-2-phenylmethoxyphenyl]urea hydrobromide Traditional Name: [2-benzoxy-5-[2-[2-(3-methoxyphenyl)ethylamino]pentyl]phenyl]urea hydrobromide Formula: C28H36BrN3O3 MolecularWeight: 542.50774

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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)OC.Br

Isomeric SMILES

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

InChI

InChI=1S/C28H35N3O3.BrH/c1-3-8-24(30-16-15-21-11-7-12-25(18-21)33-2)17-23-13-14-27(26(19-23)31-28(29)32)34-20-22-9-5-4-6-10-22;/h4-7,9-14,18-19,24,30H,3,8,15-17,20H2,1-2H3,(H3,29,31,32);1H