2-[2-bromanyl-6-methoxy-4-[(2-morpholin-4-ylethylamino)methyl]phenoxy]ethanenitrile dihydrochloride

Systemtic Name: 2-[2-bromanyl-6-methoxy-4-[(2-morpholin-4-ylethylamino)methyl]phenoxy]ethanenitrile dihydrochloride Openeye Name: 2-[2-bromo-6-methoxy-4-[(2-morpholinoethylamino)methyl]phenoxy]acetonitrile dihydrochloride CAS Name: 2-[2-bromo-6-methoxy-4-[[2-(4-morpholinyl)ethylamino]methyl]phenoxy]acetonitrile dihydrochloride IUPAC Name: 2-[2-bromo-6-methoxy-4-[(2-morpholin-4-ylethylamino)methyl]phenoxy]acetonitrile dihydrochloride Traditional Name: 2-[2-bromo-6-methoxy-4-[(2-morpholinoethylamino)methyl]phenoxy]acetonitrile dihydrochloride Formula: C16H24BrCl2N3O3 MolecularWeight: 457.19006

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)CNCCN2CCOCC2)Br)OCC#N.Cl.Cl

Isomeric SMILES

COC1=C(C(=CC(=C1)CNCCN2CCOCC2)Br)OCC#N.Cl.Cl

InChI

InChI=1S/C16H22BrN3O3.2ClH/c1-21-15-11-13(10-14(17)16(15)23-7-2-18)12-19-3-4-20-5-8-22-9-6-20;;/h10-11,19H,3-9,12H2,1H3;2*1H