1-[5-[2-(3,4-dimethylpyrrolidin-1-yl)ethyl]-2-phenylmethoxy-phenyl]urea hydrobromide

Systemtic Name: 1-[5-[2-(3,4-dimethylpyrrolidin-1-yl)ethyl]-2-phenylmethoxy-phenyl]urea hydrobromide Openeye Name: [2-benzyloxy-5-[2-(3,4-dimethylpyrrolidin-1-yl)ethyl]phenyl]urea hydrobromide CAS Name: [5-[2-(3,4-dimethyl-1-pyrrolidinyl)ethyl]-2-phenylmethoxyphenyl]urea hydrobromide IUPAC Name: [5-[2-(3,4-dimethylpyrrolidin-1-yl)ethyl]-2-phenylmethoxyphenyl]urea hydrobromide Traditional Name: [2-benzoxy-5-[2-(3,4-dimethylpyrrolidino)ethyl]phenyl]urea hydrobromide Formula: C22H30BrN3O2 MolecularWeight: 448.3965

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC1C)CCC2=CC(=C(C=C2)OCC3=CC=CC=C3)NC(=O)N.Br

Isomeric SMILES

CC1CN(CC1C)CCC2=CC(=C(C=C2)OCC3=CC=CC=C3)NC(=O)N.Br

InChI

InChI=1S/C22H29N3O2.BrH/c1-16-13-25(14-17(16)2)11-10-18-8-9-21(20(12-18)24-22(23)26)27-15-19-6-4-3-5-7-19;/h3-9,12,16-17H,10-11,13-15H2,1-2H3,(H3,23,24,26);1H