4-[[(2-chloranyl-6-fluoranyl-phenyl)methyl-cyclopropyl-amino]methyl]-8-methyl-7-oxidanyl-chromen-2-one

Systemtic Name: 4-[[(2-chloranyl-6-fluoranyl-phenyl)methyl-cyclopropyl-amino]methyl]-8-methyl-7-oxidanyl-chromen-2-one Openeye Name: 4-[[(2-chloro-6-fluoro-phenyl)methyl-cyclopropyl-amino]methyl]-7-hydroxy-8-methyl-chromen-2-one CAS Name: 4-[[(2-chloro-6-fluorophenyl)methyl-cyclopropylamino]methyl]-7-hydroxy-8-methyl-1-benzopyran-2-one IUPAC Name: 4-[[(2-chloro-6-fluorophenyl)methyl-cyclopropylamino]methyl]-7-hydroxy-8-methylchromen-2-one Traditional Name: 4-[[(2-chloro-6-fluoro-benzyl)-cyclopropyl-amino]methyl]-7-hydroxy-8-methyl-coumarin Formula: C21H19ClFNO3 MolecularWeight: 387.831863

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1OC(=O)C=C2CN(CC3=C(C=CC=C3Cl)F)C4CC4)O

Isomeric SMILES

CC1=C(C=CC2=C1OC(=O)C=C2CN(CC3=C(C=CC=C3Cl)F)C4CC4)O

InChI

InChI=1S/C21H19ClFNO3/c1-12-19(25)8-7-15-13(9-20(26)27-21(12)15)10-24(14-5-6-14)11-16-17(22)3-2-4-18(16)23/h2-4,7-9,14,25H,5-6,10-11H2,1H3