N-[[3-bromanyl-5-methoxy-4-[(4-methylphenyl)methoxy]phenyl]methyl]-2-morpholin-4-yl-ethanamine dihydrochloride

Systemtic Name: N-[[3-bromanyl-5-methoxy-4-[(4-methylphenyl)methoxy]phenyl]methyl]-2-morpholin-4-yl-ethanamine dihydrochloride Openeye Name: N-[[3-bromo-5-methoxy-4-(p-tolylmethoxy)phenyl]methyl]-2-morpholino-ethanamine dihydrochloride CAS Name: N-[[3-bromo-5-methoxy-4-[(4-methylphenyl)methoxy]phenyl]methyl]-2-(4-morpholinyl)ethanamine dihydrochloride IUPAC Name: N-[[3-bromo-5-methoxy-4-[(4-methylphenyl)methoxy]phenyl]methyl]-2-morpholin-4-ylethanamine dihydrochloride Traditional Name: [3-bromo-5-methoxy-4-(4-methylbenzyl)oxy-benzyl]-(2-morpholinoethyl)amine dihydrochloride Formula: C22H31BrCl2N2O3 MolecularWeight: 522.30314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)COC2=C(C=C(C=C2Br)CNCCN3CCOCC3)OC.Cl.Cl

Isomeric SMILES

CC1=CC=C(C=C1)COC2=C(C=C(C=C2Br)CNCCN3CCOCC3)OC.Cl.Cl

InChI

InChI=1S/C22H29BrN2O3.2ClH/c1-17-3-5-18(6-4-17)16-28-22-20(23)13-19(14-21(22)26-2)15-24-7-8-25-9-11-27-12-10-25;;/h3-6,13-14,24H,7-12,15-16H2,1-2H3;2*1H