2-[5-bromanyl-2-ethoxy-4-[(3-oxidanylpropylamino)methyl]phenoxy]-N-phenyl-ethanamide

Systemtic Name: 2-[5-bromanyl-2-ethoxy-4-[(3-oxidanylpropylamino)methyl]phenoxy]-N-phenyl-ethanamide Openeye Name: 2-[5-bromo-2-ethoxy-4-[(3-hydroxypropylamino)methyl]phenoxy]-N-phenyl-acetamide CAS Name: 2-[5-bromo-2-ethoxy-4-[(3-hydroxypropylamino)methyl]phenoxy]-N-phenylacetamide IUPAC Name: 2-[5-bromo-2-ethoxy-4-[(3-hydroxypropylamino)methyl]phenoxy]-N-phenylacetamide Traditional Name: 2-[5-bromo-2-ethoxy-4-[(3-hydroxypropylamino)methyl]phenoxy]-N-phenyl-acetamide Formula: C20H25BrN2O4 MolecularWeight: 437.3275

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)CNCCCO)Br)OCC(=O)NC2=CC=CC=C2

Isomeric SMILES

CCOC1=C(C=C(C(=C1)CNCCCO)Br)OCC(=O)NC2=CC=CC=C2

InChI

InChI=1S/C20H25BrN2O4/c1-2-26-18-11-15(13-22-9-6-10-24)17(21)12-19(18)27-14-20(25)23-16-7-4-3-5-8-16/h3-5,7-8,11-12,22,24H,2,6,9-10,13-14H2,1H3,(H,23,25)