(1S)-2-(1,3-benzodioxol-5-ylamino)-1-(2-chloranyl-6-fluoranyl-phenyl)ethanol

Systemtic Name: (1S)-2-(1,3-benzodioxol-5-ylamino)-1-(2-chloranyl-6-fluoranyl-phenyl)ethanol Openeye Name: (1S)-2-(1,3-benzodioxol-5-ylamino)-1-(2-chloro-6-fluoro-phenyl)ethanol CAS Name: (1S)-2-(1,3-benzodioxol-5-ylamino)-1-(2-chloro-6-fluorophenyl)ethanol IUPAC Name: (1S)-2-(1,3-benzodioxol-5-ylamino)-1-(2-chloro-6-fluorophenyl)ethanol Traditional Name: (1S)-2-(1,3-benzodioxol-5-ylamino)-1-(2-chloro-6-fluoro-phenyl)ethanol Formula: C15H13ClFNO3 MolecularWeight: 309.720023

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NCC(C3=C(C=CC=C3Cl)F)O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC[C@H](C3=C(C=CC=C3Cl)F)O

InChI

InChI=1S/C15H13ClFNO3/c16-10-2-1-3-11(17)15(10)12(19)7-18-9-4-5-13-14(6-9)21-8-20-13/h1-6,12,18-19H,7-8H2/t12-/m1/s1