2-[5-bromanyl-2-ethoxy-4-[(1-phenylethylamino)methyl]phenoxy]-N-phenethyl-ethanamide hydrochloride

Systemtic Name: 2-[5-bromanyl-2-ethoxy-4-[(1-phenylethylamino)methyl]phenoxy]-N-phenethyl-ethanamide hydrochloride Openeye Name: 2-[5-bromo-2-ethoxy-4-[(1-phenylethylamino)methyl]phenoxy]-N-phenethyl-acetamide hydrochloride CAS Name: 2-[5-bromo-2-ethoxy-4-[(1-phenylethylamino)methyl]phenoxy]-N-phenethylacetamide hydrochloride IUPAC Name: 2-[5-bromo-2-ethoxy-4-[(1-phenylethylamino)methyl]phenoxy]-N-phenethylacetamide hydrochloride Traditional Name: 2-[5-bromo-2-ethoxy-4-[(1-phenylethylamino)methyl]phenoxy]-N-phenethyl-acetamide hydrochloride Formula: C27H32BrClN2O3 MolecularWeight: 547.91158

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)CNC(C)C2=CC=CC=C2)Br)OCC(=O)NCCC3=CC=CC=C3.Cl

Isomeric SMILES

CCOC1=C(C=C(C(=C1)CNC(C)C2=CC=CC=C2)Br)OCC(=O)NCCC3=CC=CC=C3.Cl

InChI

InChI=1S/C27H31BrN2O3.ClH/c1-3-32-25-16-23(18-30-20(2)22-12-8-5-9-13-22)24(28)17-26(25)33-19-27(31)29-15-14-21-10-6-4-7-11-21;/h4-13,16-17,20,30H,3,14-15,18-19H2,1-2H3,(H,29,31);1H