2-azanyl-4-[3,5-bis(trifluoromethyl)phenyl]-5,6-dihydro-4H-benzo[h]chromene-3-carbonitrile

Systemtic Name: 2-azanyl-4-[3,5-bis(trifluoromethyl)phenyl]-5,6-dihydro-4H-benzo[h]chromene-3-carbonitrile Openeye Name: 2-amino-4-[3,5-bis(trifluoromethyl)phenyl]-5,6-dihydro-4H-benzo[h]chromene-3-carbonitrile CAS Name: 2-amino-4-[3,5-bis(trifluoromethyl)phenyl]-5,6-dihydro-4H-benzo[h][1]benzopyran-3-carbonitrile IUPAC Name: 2-amino-4-[3,5-bis(trifluoromethyl)phenyl]-5,6-dihydro-4H-benzo[h]chromene-3-carbonitrile Traditional Name: 2-amino-4-[3,5-bis(trifluoromethyl)phenyl]-5,6-dihydro-4H-benzo[h]chromene-3-carbonitrile Formula: C22H14F6N2O MolecularWeight: 436.349779

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C3=CC=CC=C31)OC(=C(C2C4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F)C#N)N

Isomeric SMILES

C1CC2=C(C3=CC=CC=C31)OC(=C(C2C4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F)C#N)N

InChI

InChI=1S/C22H14F6N2O/c23-21(24,25)13-7-12(8-14(9-13)22(26,27)28)18-16-6-5-11-3-1-2-4-15(11)19(16)31-20(30)17(18)10-29/h1-4,7-9,18H,5-6,30H2