1-tert-butyl-4,6-bis(trifluoromethyl)pyrrolo[2,3-b]pyridine-3-carbonitrile

Systemtic Name: 1-tert-butyl-4,6-bis(trifluoromethyl)pyrrolo[2,3-b]pyridine-3-carbonitrile Openeye Name: 1-tert-butyl-4,6-bis(trifluoromethyl)pyrrolo[2,3-b]pyridine-3-carbonitrile CAS Name: 1-tert-butyl-4,6-bis(trifluoromethyl)-3-pyrrolo[2,3-b]pyridinecarbonitrile IUPAC Name: 1-tert-butyl-4,6-bis(trifluoromethyl)pyrrolo[2,3-b]pyridine-3-carbonitrile Traditional Name: 1-tert-butyl-4,6-bis(trifluoromethyl)pyrrolo[2,3-b]pyridine-3-carbonitrile Formula: C14H11F6N3 MolecularWeight: 335.247659

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C=C(C2=C1N=C(C=C2C(F)(F)F)C(F)(F)F)C#N

Isomeric SMILES

CC(C)(C)N1C=C(C2=C1N=C(C=C2C(F)(F)F)C(F)(F)F)C#N

InChI

InChI=1S/C14H11F6N3/c1-12(2,3)23-6-7(5-21)10-8(13(15,16)17)4-9(14(18,19)20)22-11(10)23/h4,6H,1-3H3