2-azanyl-4-[3-bromanyl-4-[(2-chloranyl-6-fluoranyl-phenyl)methoxy]phenyl]-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-chromene-3-carbonitrile

Systemtic Name: 2-azanyl-4-[3-bromanyl-4-[(2-chloranyl-6-fluoranyl-phenyl)methoxy]phenyl]-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-chromene-3-carbonitrile Openeye Name: 2-amino-4-[3-bromo-4-[(2-chloro-6-fluoro-phenyl)methoxy]phenyl]-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carbonitrile CAS Name: 2-amino-4-[3-bromo-4-[(2-chloro-6-fluorophenyl)methoxy]phenyl]-7,7-dimethyl-5-oxo-6,8-dihydro-4H-1-benzopyran-3-carbonitrile IUPAC Name: 2-amino-4-[3-bromo-4-[(2-chloro-6-fluorophenyl)methoxy]phenyl]-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carbonitrile Traditional Name: 2-amino-4-[3-bromo-4-(2-chloro-6-fluoro-benzyl)oxy-phenyl]-5-keto-7,7-dimethyl-6,8-dihydro-4H-chromene-3-carbonitrile Formula: C25H21BrClFN2O3 MolecularWeight: 531.801243

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(C(=C(O2)N)C#N)C3=CC(=C(C=C3)OCC4=C(C=CC=C4Cl)F)Br)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C(C(=C(O2)N)C#N)C3=CC(=C(C=C3)OCC4=C(C=CC=C4Cl)F)Br)C(=O)C1)C

InChI

InChI=1S/C25H21BrClFN2O3/c1-25(2)9-19(31)23-21(10-25)33-24(30)14(11-29)22(23)13-6-7-20(16(26)8-13)32-12-15-17(27)4-3-5-18(15)28/h3-8,22H,9-10,12,30H2,1-2H3