2-azanyl-4-[3,4-bis(fluoranyl)phenyl]-6-hexyl-7-oxidanyl-4H-chromene-3-carbonitrile

Systemtic Name: 2-azanyl-4-[3,4-bis(fluoranyl)phenyl]-6-hexyl-7-oxidanyl-4H-chromene-3-carbonitrile Openeye Name: 2-amino-4-(3,4-difluorophenyl)-6-hexyl-7-hydroxy-4H-chromene-3-carbonitrile CAS Name: 2-amino-4-(3,4-difluorophenyl)-6-hexyl-7-hydroxy-4H-1-benzopyran-3-carbonitrile IUPAC Name: 2-amino-4-(3,4-difluorophenyl)-6-hexyl-7-hydroxy-4H-chromene-3-carbonitrile Traditional Name: 2-amino-4-(3,4-difluorophenyl)-6-hexyl-7-hydroxy-4H-chromene-3-carbonitrile Formula: C22H22F2N2O2 MolecularWeight: 384.419086

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C=C2C(=C1)C(C(=C(O2)N)C#N)C3=CC(=C(C=C3)F)F)O

Isomeric SMILES

CCCCCCC1=C(C=C2C(=C1)C(C(=C(O2)N)C#N)C3=CC(=C(C=C3)F)F)O

InChI

InChI=1S/C22H22F2N2O2/c1-2-3-4-5-6-13-9-15-20(11-19(13)27)28-22(26)16(12-25)21(15)14-7-8-17(23)18(24)10-14/h7-11,21,27H,2-6,26H2,1H3