4-methyl-5-[[4-nitro-2-(trifluoromethyl)phenyl]diazenyl]-2-(phenethylamino)-6-phenylazanyl-pyridine-3-carbonitrile

Systemtic Name: 4-methyl-5-[[4-nitro-2-(trifluoromethyl)phenyl]diazenyl]-2-(phenethylamino)-6-phenylazanyl-pyridine-3-carbonitrile Openeye Name: 6-anilino-4-methyl-5-[4-nitro-2-(trifluoromethyl)phenyl]azo-2-(phenethylamino)pyridine-3-carbonitrile CAS Name: 6-anilino-4-methyl-5-[4-nitro-2-(trifluoromethyl)phenyl]azo-2-(phenethylamino)-3-pyridinecarbonitrile IUPAC Name: 6-anilino-4-methyl-5-[[4-nitro-2-(trifluoromethyl)phenyl]diazenyl]-2-(phenethylamino)pyridine-3-carbonitrile Traditional Name: 6-anilino-4-methyl-5-[4-nitro-2-(trifluoromethyl)phenyl]azo-2-(phenethylamino)nicotinonitrile Formula: C28H22F3N7O2 MolecularWeight: 545.51519

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=C1N=NC2=C(C=C(C=C2)[N+](=O)[O-])C(F)(F)F)NC3=CC=CC=C3)NCCC4=CC=CC=C4)C#N

Isomeric SMILES

CC1=C(C(=NC(=C1N=NC2=C(C=C(C=C2)[N+](=O)[O-])C(F)(F)F)NC3=CC=CC=C3)NCCC4=CC=CC=C4)C#N

InChI

InChI=1S/C28H22F3N7O2/c1-18-22(17-32)26(33-15-14-19-8-4-2-5-9-19)35-27(34-20-10-6-3-7-11-20)25(18)37-36-24-13-12-21(38(39)40)16-23(24)28(29,30)31/h2-13,16H,14-15H2,1H3,(H2,33,34,35)