2-[2-bromanyl-6-methoxy-4-[(3-morpholin-4-ylpropylamino)methyl]phenoxy]-N-phenethyl-ethanamide dihydrochloride

Systemtic Name: 2-[2-bromanyl-6-methoxy-4-[(3-morpholin-4-ylpropylamino)methyl]phenoxy]-N-phenethyl-ethanamide dihydrochloride Openeye Name: 2-[2-bromo-6-methoxy-4-[(3-morpholinopropylamino)methyl]phenoxy]-N-phenethyl-acetamide dihydrochloride CAS Name: 2-[2-bromo-6-methoxy-4-[[3-(4-morpholinyl)propylamino]methyl]phenoxy]-N-phenethylacetamide dihydrochloride IUPAC Name: 2-[2-bromo-6-methoxy-4-[(3-morpholin-4-ylpropylamino)methyl]phenoxy]-N-phenethylacetamide dihydrochloride Traditional Name: 2-[2-bromo-6-methoxy-4-[(3-morpholinopropylamino)methyl]phenoxy]-N-phenethyl-acetamide dihydrochloride Formula: C25H36BrCl2N3O4 MolecularWeight: 593.38104

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)CNCCCN2CCOCC2)Br)OCC(=O)NCCC3=CC=CC=C3.Cl.Cl

Isomeric SMILES

COC1=C(C(=CC(=C1)CNCCCN2CCOCC2)Br)OCC(=O)NCCC3=CC=CC=C3.Cl.Cl

InChI

InChI=1S/C25H34BrN3O4.2ClH/c1-31-23-17-21(18-27-9-5-11-29-12-14-32-15-13-29)16-22(26)25(23)33-19-24(30)28-10-8-20-6-3-2-4-7-20;;/h2-4,6-7,16-17,27H,5,8-15,18-19H2,1H3,(H,28,30);2*1H