6-ethyl-4-[[(5-fluoranyl-2-methyl-phenyl)amino]methyl]-7-oxidanyl-chromen-2-one

Systemtic Name: 6-ethyl-4-[[(5-fluoranyl-2-methyl-phenyl)amino]methyl]-7-oxidanyl-chromen-2-one Openeye Name: 6-ethyl-4-[(5-fluoro-2-methyl-anilino)methyl]-7-hydroxy-chromen-2-one CAS Name: 6-ethyl-4-[(5-fluoro-2-methylanilino)methyl]-7-hydroxy-1-benzopyran-2-one IUPAC Name: 6-ethyl-4-[(5-fluoro-2-methylanilino)methyl]-7-hydroxychromen-2-one Traditional Name: 6-ethyl-4-[(5-fluoro-2-methyl-anilino)methyl]-7-hydroxy-coumarin Formula: C19H18FNO3 MolecularWeight: 327.349523

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)CNC3=C(C=CC(=C3)F)C)O

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)CNC3=C(C=CC(=C3)F)C)O

InChI

InChI=1S/C19H18FNO3/c1-3-12-6-15-13(7-19(23)24-18(15)9-17(12)22)10-21-16-8-14(20)5-4-11(16)2/h4-9,21-22H,3,10H2,1-2H3