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

Systemtic Name: 6-[[(2-chloranyl-6-fluoranyl-phenyl)methylamino]methyl]-8-methyl-7-oxidanyl-4-phenyl-chromen-2-one hydrochloride Openeye Name: 6-[[(2-chloro-6-fluoro-phenyl)methylamino]methyl]-7-hydroxy-8-methyl-4-phenyl-chromen-2-one hydrochloride CAS Name: 6-[[(2-chloro-6-fluorophenyl)methylamino]methyl]-7-hydroxy-8-methyl-4-phenyl-1-benzopyran-2-one hydrochloride IUPAC Name: 6-[[(2-chloro-6-fluorophenyl)methylamino]methyl]-7-hydroxy-8-methyl-4-phenylchromen-2-one hydrochloride Traditional Name: 6-[[(2-chloro-6-fluoro-benzyl)amino]methyl]-7-hydroxy-8-methyl-4-phenyl-coumarin hydrochloride Formula: C24H20Cl2FNO3 MolecularWeight: 460.324903

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1O)CNCC3=C(C=CC=C3Cl)F)C(=CC(=O)O2)C4=CC=CC=C4.Cl

Isomeric SMILES

CC1=C2C(=CC(=C1O)CNCC3=C(C=CC=C3Cl)F)C(=CC(=O)O2)C4=CC=CC=C4.Cl

InChI

InChI=1S/C24H19ClFNO3.ClH/c1-14-23(29)16(12-27-13-19-20(25)8-5-9-21(19)26)10-18-17(11-22(28)30-24(14)18)15-6-3-2-4-7-15;/h2-11,27,29H,12-13H2,1H3;1H