2-azanyl-4-(3-bromanyl-4-fluoranyl-phenyl)-7-methyl-5-oxidanylidene-4,6,7,8-tetrahydrochromene-3-carbonitrile

Systemtic Name: 2-azanyl-4-(3-bromanyl-4-fluoranyl-phenyl)-7-methyl-5-oxidanylidene-4,6,7,8-tetrahydrochromene-3-carbonitrile Openeye Name: 2-amino-4-(3-bromo-4-fluoro-phenyl)-7-methyl-5-oxo-4,6,7,8-tetrahydrochromene-3-carbonitrile CAS Name: 2-amino-4-(3-bromo-4-fluorophenyl)-7-methyl-5-oxo-4,6,7,8-tetrahydro-1-benzopyran-3-carbonitrile IUPAC Name: 2-amino-4-(3-bromo-4-fluorophenyl)-7-methyl-5-oxo-4,6,7,8-tetrahydrochromene-3-carbonitrile Traditional Name: 2-amino-4-(3-bromo-4-fluoro-phenyl)-5-keto-7-methyl-4,6,7,8-tetrahydrochromene-3-carbonitrile Formula: C17H14BrFN2O2 MolecularWeight: 377.207663

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=C(C(C(=C(O2)N)C#N)C3=CC(=C(C=C3)F)Br)C(=O)C1

Isomeric SMILES

CC1CC2=C(C(C(=C(O2)N)C#N)C3=CC(=C(C=C3)F)Br)C(=O)C1

InChI

InChI=1S/C17H14BrFN2O2/c1-8-4-13(22)16-14(5-8)23-17(21)10(7-20)15(16)9-2-3-12(19)11(18)6-9/h2-3,6,8,15H,4-5,21H2,1H3