(4R)-4-(5-bromanyl-2-fluoranyl-phenyl)-5-oxidanylidene-2-pyrrol-1-yl-4,6,7,8-tetrahydrochromene-3-carbonitrile

Systemtic Name: (4R)-4-(5-bromanyl-2-fluoranyl-phenyl)-5-oxidanylidene-2-pyrrol-1-yl-4,6,7,8-tetrahydrochromene-3-carbonitrile Openeye Name: (4R)-4-(5-bromo-2-fluoro-phenyl)-5-oxo-2-pyrrol-1-yl-4,6,7,8-tetrahydrochromene-3-carbonitrile CAS Name: (4R)-4-(5-bromo-2-fluorophenyl)-5-oxo-2-(1-pyrrolyl)-4,6,7,8-tetrahydro-1-benzopyran-3-carbonitrile IUPAC Name: (4R)-4-(5-bromo-2-fluorophenyl)-5-oxo-2-pyrrol-1-yl-4,6,7,8-tetrahydrochromene-3-carbonitrile Traditional Name: (4R)-4-(5-bromo-2-fluoro-phenyl)-5-keto-2-pyrrol-1-yl-4,6,7,8-tetrahydrochromene-3-carbonitrile Formula: C20H14BrFN2O2 MolecularWeight: 413.239763

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C(C(=C(O2)N3C=CC=C3)C#N)C4=C(C=CC(=C4)Br)F)C(=O)C1

Isomeric SMILES

C1CC2=C([C@@H](C(=C(O2)N3C=CC=C3)C#N)C4=C(C=CC(=C4)Br)F)C(=O)C1

InChI

InChI=1S/C20H14BrFN2O2/c21-12-6-7-15(22)13(10-12)18-14(11-23)20(24-8-1-2-9-24)26-17-5-3-4-16(25)19(17)18/h1-2,6-10,18H,3-5H2/t18-/m1/s1