N-[(3-bromanyl-5-methoxy-4-phenylmethoxy-phenyl)methyl]-1-[(2R)-oxolan-2-yl]methanamine

Systemtic Name: N-[(3-bromanyl-5-methoxy-4-phenylmethoxy-phenyl)methyl]-1-[(2R)-oxolan-2-yl]methanamine Openeye Name: N-[(4-benzyloxy-3-bromo-5-methoxy-phenyl)methyl]-1-[(2R)-tetrahydrofuran-2-yl]methanamine CAS Name: N-[(3-bromo-5-methoxy-4-phenylmethoxyphenyl)methyl]-1-[(2R)-2-oxolanyl]methanamine IUPAC Name: N-[(3-bromo-5-methoxy-4-phenylmethoxyphenyl)methyl]-1-[(2R)-oxolan-2-yl]methanamine Traditional Name: (4-benzoxy-3-bromo-5-methoxy-benzyl)-[[(2R)-tetrahydrofuran-2-yl]methyl]amine Formula: C20H24BrNO3 MolecularWeight: 406.31346

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)CNCC2CCCO2)Br)OCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C(=CC(=C1)CNC[C@H]2CCCO2)Br)OCC3=CC=CC=C3

InChI

InChI=1S/C20H24BrNO3/c1-23-19-11-16(12-22-13-17-8-5-9-24-17)10-18(21)20(19)25-14-15-6-3-2-4-7-15/h2-4,6-7,10-11,17,22H,5,8-9,12-14H2,1H3/t17-/m1/s1