2-azanyl-6-(2,5-dimethylphenyl)-4-(4-octoxyphenyl)pyridine-3-carbonitrile

Systemtic Name: 2-azanyl-6-(2,5-dimethylphenyl)-4-(4-octoxyphenyl)pyridine-3-carbonitrile Openeye Name: 2-amino-6-(2,5-dimethylphenyl)-4-(4-octoxyphenyl)pyridine-3-carbonitrile CAS Name: 2-amino-6-(2,5-dimethylphenyl)-4-(4-octoxyphenyl)-3-pyridinecarbonitrile IUPAC Name: 2-amino-6-(2,5-dimethylphenyl)-4-(4-octoxyphenyl)pyridine-3-carbonitrile Traditional Name: 2-amino-6-(2,5-dimethylphenyl)-4-(4-octoxyphenyl)nicotinonitrile Formula: C28H33N3O MolecularWeight: 427.58112

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C2=CC(=NC(=C2C#N)N)C3=C(C=CC(=C3)C)C

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C2=CC(=NC(=C2C#N)N)C3=C(C=CC(=C3)C)C

InChI

InChI=1S/C28H33N3O/c1-4-5-6-7-8-9-16-32-23-14-12-22(13-15-23)25-18-27(31-28(30)26(25)19-29)24-17-20(2)10-11-21(24)3/h10-15,17-18H,4-9,16H2,1-3H3,(H2,30,31)