6-[[(2-chloranyl-6-fluoranyl-phenyl)methyl-methyl-amino]methyl]-1,3-benzodioxol-5-ol

Systemtic Name: 6-[[(2-chloranyl-6-fluoranyl-phenyl)methyl-methyl-amino]methyl]-1,3-benzodioxol-5-ol Openeye Name: 6-[[(2-chloro-6-fluoro-phenyl)methyl-methyl-amino]methyl]-1,3-benzodioxol-5-ol CAS Name: 6-[[(2-chloro-6-fluorophenyl)methyl-methylamino]methyl]-1,3-benzodioxol-5-ol IUPAC Name: 6-[[(2-chloro-6-fluorophenyl)methyl-methylamino]methyl]-1,3-benzodioxol-5-ol Traditional Name: 6-[[(2-chloro-6-fluoro-benzyl)-methyl-amino]methyl]sesamol Formula: C16H15ClFNO3 MolecularWeight: 323.746603

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC2=C(C=C1O)OCO2)CC3=C(C=CC=C3Cl)F

Isomeric SMILES

CN(CC1=CC2=C(C=C1O)OCO2)CC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C16H15ClFNO3/c1-19(8-11-12(17)3-2-4-13(11)18)7-10-5-15-16(6-14(10)20)22-9-21-15/h2-6,20H,7-9H2,1H3