7-(3-bromanylpropylamino)-4-(trifluoromethyl)chromen-2-one

Systemtic Name: 7-(3-bromanylpropylamino)-4-(trifluoromethyl)chromen-2-one Openeye Name: 7-(3-bromopropylamino)-4-(trifluoromethyl)chromen-2-one CAS Name: 7-(3-bromopropylamino)-4-(trifluoromethyl)-1-benzopyran-2-one IUPAC Name: 7-(3-bromopropylamino)-4-(trifluoromethyl)chromen-2-one Traditional Name: 7-(3-bromopropylamino)-4-(trifluoromethyl)coumarin Formula: C13H11BrF3NO2 MolecularWeight: 350.13115

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1NCCCBr)OC(=O)C=C2C(F)(F)F

Isomeric SMILES

C1=CC2=C(C=C1NCCCBr)OC(=O)C=C2C(F)(F)F

InChI

InChI=1S/C13H11BrF3NO2/c14-4-1-5-18-8-2-3-9-10(13(15,16)17)7-12(19)20-11(9)6-8/h2-3,6-7,18H,1,4-5H2