(2R)-2-[[3-bromanyl-4-[(4-chlorophenyl)methoxy]-5-ethoxy-phenyl]methylamino]butan-1-ol

Systemtic Name: (2R)-2-[[3-bromanyl-4-[(4-chlorophenyl)methoxy]-5-ethoxy-phenyl]methylamino]butan-1-ol Openeye Name: (2R)-2-[[3-bromo-4-[(4-chlorophenyl)methoxy]-5-ethoxy-phenyl]methylamino]butan-1-ol CAS Name: (2R)-2-[[3-bromo-4-[(4-chlorophenyl)methoxy]-5-ethoxyphenyl]methylamino]-1-butanol IUPAC Name: (2R)-2-[[3-bromo-4-[(4-chlorophenyl)methoxy]-5-ethoxyphenyl]methylamino]butan-1-ol Traditional Name: (2R)-2-[[3-bromo-4-(4-chlorobenzyl)oxy-5-ethoxy-benzyl]amino]butan-1-ol Formula: C20H25BrClNO3 MolecularWeight: 442.7744

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)NCC1=CC(=C(C(=C1)Br)OCC2=CC=C(C=C2)Cl)OCC

Isomeric SMILES

CC[C@H](CO)NCC1=CC(=C(C(=C1)Br)OCC2=CC=C(C=C2)Cl)OCC

InChI

InChI=1S/C20H25BrClNO3/c1-3-17(12-24)23-11-15-9-18(21)20(19(10-15)25-4-2)26-13-14-5-7-16(22)8-6-14/h5-10,17,23-24H,3-4,11-13H2,1-2H3/t17-/m1/s1