(4S)-4-(2-chloranyl-6-fluoranyl-phenyl)-7,7-dimethyl-5-oxidanylidene-2-pyrrol-1-yl-6,8-dihydro-4H-chromene-3-carbonitrile

Systemtic Name: (4S)-4-(2-chloranyl-6-fluoranyl-phenyl)-7,7-dimethyl-5-oxidanylidene-2-pyrrol-1-yl-6,8-dihydro-4H-chromene-3-carbonitrile Openeye Name: (4S)-4-(2-chloro-6-fluoro-phenyl)-7,7-dimethyl-5-oxo-2-pyrrol-1-yl-6,8-dihydro-4H-chromene-3-carbonitrile CAS Name: (4S)-4-(2-chloro-6-fluorophenyl)-7,7-dimethyl-5-oxo-2-(1-pyrrolyl)-6,8-dihydro-4H-1-benzopyran-3-carbonitrile IUPAC Name: (4S)-4-(2-chloro-6-fluorophenyl)-7,7-dimethyl-5-oxo-2-pyrrol-1-yl-6,8-dihydro-4H-chromene-3-carbonitrile Traditional Name: (4S)-4-(2-chloro-6-fluoro-phenyl)-5-keto-7,7-dimethyl-2-pyrrol-1-yl-6,8-dihydro-4H-chromene-3-carbonitrile Formula: C22H18ClFN2O2 MolecularWeight: 396.841923

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(C(=C(O2)N3C=CC=C3)C#N)C4=C(C=CC=C4Cl)F)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C([C@H](C(=C(O2)N3C=CC=C3)C#N)C4=C(C=CC=C4Cl)F)C(=O)C1)C

InChI

InChI=1S/C22H18ClFN2O2/c1-22(2)10-16(27)20-17(11-22)28-21(26-8-3-4-9-26)13(12-25)18(20)19-14(23)6-5-7-15(19)24/h3-9,18H,10-11H2,1-2H3/t18-/m1/s1