2-azanyl-6-methyl-4-(4-octoxyphenyl)-5-phenyl-pyridine-3-carbonitrile

Systemtic Name: 2-azanyl-6-methyl-4-(4-octoxyphenyl)-5-phenyl-pyridine-3-carbonitrile Openeye Name: 2-amino-6-methyl-4-(4-octoxyphenyl)-5-phenyl-pyridine-3-carbonitrile CAS Name: 2-amino-6-methyl-4-(4-octoxyphenyl)-5-phenyl-3-pyridinecarbonitrile IUPAC Name: 2-amino-6-methyl-4-(4-octoxyphenyl)-5-phenylpyridine-3-carbonitrile Traditional Name: 2-amino-6-methyl-4-(4-octoxyphenyl)-5-phenyl-nicotinonitrile Formula: C27H31N3O MolecularWeight: 413.55454

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C2=C(C(=NC(=C2C3=CC=CC=C3)C)N)C#N

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C2=C(C(=NC(=C2C3=CC=CC=C3)C)N)C#N

InChI

InChI=1S/C27H31N3O/c1-3-4-5-6-7-11-18-31-23-16-14-22(15-17-23)26-24(19-28)27(29)30-20(2)25(26)21-12-9-8-10-13-21/h8-10,12-17H,3-7,11,18H2,1-2H3,(H2,29,30)