8-[[(2-chloranyl-6-fluoranyl-phenyl)methylamino]methyl]-4-ethyl-7-oxidanyl-chromen-2-one hydrochloride

Systemtic Name: 8-[[(2-chloranyl-6-fluoranyl-phenyl)methylamino]methyl]-4-ethyl-7-oxidanyl-chromen-2-one hydrochloride Openeye Name: 8-[[(2-chloro-6-fluoro-phenyl)methylamino]methyl]-4-ethyl-7-hydroxy-chromen-2-one hydrochloride CAS Name: 8-[[(2-chloro-6-fluorophenyl)methylamino]methyl]-4-ethyl-7-hydroxy-1-benzopyran-2-one hydrochloride IUPAC Name: 8-[[(2-chloro-6-fluorophenyl)methylamino]methyl]-4-ethyl-7-hydroxychromen-2-one hydrochloride Traditional Name: 8-[[(2-chloro-6-fluoro-benzyl)amino]methyl]-4-ethyl-7-hydroxy-coumarin hydrochloride Formula: C19H18Cl2FNO3 MolecularWeight: 398.255523

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=O)OC2=C1C=CC(=C2CNCC3=C(C=CC=C3Cl)F)O.Cl

Isomeric SMILES

CCC1=CC(=O)OC2=C1C=CC(=C2CNCC3=C(C=CC=C3Cl)F)O.Cl

InChI

InChI=1S/C19H17ClFNO3.ClH/c1-2-11-8-18(24)25-19-12(11)6-7-17(23)14(19)10-22-9-13-15(20)4-3-5-16(13)21;/h3-8,22-23H,2,9-10H2,1H3;1H