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

Systemtic Name: 2-azanyl-4-[2-[(2-chloranyl-6-fluoranyl-phenyl)methoxy]phenyl]-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-chromene-3-carbonitrile Openeye Name: 2-amino-4-[2-[(2-chloro-6-fluoro-phenyl)methoxy]phenyl]-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carbonitrile CAS Name: 2-amino-4-[2-[(2-chloro-6-fluorophenyl)methoxy]phenyl]-7,7-dimethyl-5-oxo-6,8-dihydro-4H-1-benzopyran-3-carbonitrile IUPAC Name: 2-amino-4-[2-[(2-chloro-6-fluorophenyl)methoxy]phenyl]-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carbonitrile Traditional Name: 2-amino-4-[2-(2-chloro-6-fluoro-benzyl)oxyphenyl]-5-keto-7,7-dimethyl-6,8-dihydro-4H-chromene-3-carbonitrile Formula: C25H22ClFN2O3 MolecularWeight: 452.905183

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(C(=C(O2)N)C#N)C3=CC=CC=C3OCC4=C(C=CC=C4Cl)F)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C(C(=C(O2)N)C#N)C3=CC=CC=C3OCC4=C(C=CC=C4Cl)F)C(=O)C1)C

InChI

InChI=1S/C25H22ClFN2O3/c1-25(2)10-19(30)23-21(11-25)32-24(29)15(12-28)22(23)14-6-3-4-9-20(14)31-13-16-17(26)7-5-8-18(16)27/h3-9,22H,10-11,13,29H2,1-2H3