6-[(4-bromophenyl)-morpholin-4-yl-methyl]-1,3-benzodioxol-5-ol

Systemtic Name: 6-[(4-bromophenyl)-morpholin-4-yl-methyl]-1,3-benzodioxol-5-ol Openeye Name: 6-[(4-bromophenyl)-morpholino-methyl]-1,3-benzodioxol-5-ol CAS Name: 6-[(4-bromophenyl)-(4-morpholinyl)methyl]-1,3-benzodioxol-5-ol IUPAC Name: 6-[(4-bromophenyl)-morpholin-4-ylmethyl]-1,3-benzodioxol-5-ol Traditional Name: 6-[(4-bromophenyl)-morpholino-methyl]sesamol Formula: C18H18BrNO4 MolecularWeight: 392.24382

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(C2=CC=C(C=C2)Br)C3=CC4=C(C=C3O)OCO4

Isomeric SMILES

C1COCCN1C(C2=CC=C(C=C2)Br)C3=CC4=C(C=C3O)OCO4

InChI

InChI=1S/C18H18BrNO4/c19-13-3-1-12(2-4-13)18(20-5-7-22-8-6-20)14-9-16-17(10-15(14)21)24-11-23-16/h1-4,9-10,18,21H,5-8,11H2