5-[3-(2-chloranyl-6-fluoranyl-phenyl)-2-methyl-4-oxidanylidene-chromen-7-yl]oxypentanenitrile

Systemtic Name: 5-[3-(2-chloranyl-6-fluoranyl-phenyl)-2-methyl-4-oxidanylidene-chromen-7-yl]oxypentanenitrile Openeye Name: 5-[3-(2-chloro-6-fluoro-phenyl)-2-methyl-4-oxo-chromen-7-yl]oxypentanenitrile CAS Name: 5-[[3-(2-chloro-6-fluorophenyl)-2-methyl-4-oxo-1-benzopyran-7-yl]oxy]pentanenitrile IUPAC Name: 5-[3-(2-chloro-6-fluorophenyl)-2-methyl-4-oxochromen-7-yl]oxypentanenitrile Traditional Name: 5-[3-(2-chloro-6-fluoro-phenyl)-4-keto-2-methyl-chromen-7-yl]oxyvaleronitrile Formula: C21H17ClFNO3 MolecularWeight: 385.815983

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=C(O1)C=C(C=C2)OCCCCC#N)C3=C(C=CC=C3Cl)F

Isomeric SMILES

CC1=C(C(=O)C2=C(O1)C=C(C=C2)OCCCCC#N)C3=C(C=CC=C3Cl)F

InChI

InChI=1S/C21H17ClFNO3/c1-13-19(20-16(22)6-5-7-17(20)23)21(25)15-9-8-14(12-18(15)27-13)26-11-4-2-3-10-24/h5-9,12H,2-4,11H2,1H3