N-[[3-bromanyl-5-methoxy-4-(pyridin-3-ylmethoxy)phenyl]methyl]-N',N'-diethyl-ethane-1,2-diamine

Systemtic Name: N-[[3-bromanyl-5-methoxy-4-(pyridin-3-ylmethoxy)phenyl]methyl]-N',N'-diethyl-ethane-1,2-diamine Openeye Name: N-[[3-bromo-5-methoxy-4-(3-pyridylmethoxy)phenyl]methyl]-N',N'-diethyl-ethane-1,2-diamine CAS Name: N-[[3-bromo-5-methoxy-4-(3-pyridinylmethoxy)phenyl]methyl]-N',N'-diethylethane-1,2-diamine IUPAC Name: N-[[3-bromo-5-methoxy-4-(pyridin-3-ylmethoxy)phenyl]methyl]-N',N'-diethylethane-1,2-diamine Traditional Name: 2-[[3-bromo-5-methoxy-4-(3-pyridylmethoxy)benzyl]amino]ethyl-diethyl-amine Formula: C20H28BrN3O2 MolecularWeight: 422.35922

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNCC1=CC(=C(C(=C1)Br)OCC2=CN=CC=C2)OC

Isomeric SMILES

CCN(CC)CCNCC1=CC(=C(C(=C1)Br)OCC2=CN=CC=C2)OC

InChI

InChI=1S/C20H28BrN3O2/c1-4-24(5-2)10-9-23-14-17-11-18(21)20(19(12-17)25-3)26-15-16-7-6-8-22-13-16/h6-8,11-13,23H,4-5,9-10,14-15H2,1-3H3