2-azanyl-6-(3-methoxyphenyl)-4-(4-octoxyphenyl)pyridine-3-carbonitrile

Systemtic Name: 2-azanyl-6-(3-methoxyphenyl)-4-(4-octoxyphenyl)pyridine-3-carbonitrile Openeye Name: 2-amino-6-(3-methoxyphenyl)-4-(4-octoxyphenyl)pyridine-3-carbonitrile CAS Name: 2-amino-6-(3-methoxyphenyl)-4-(4-octoxyphenyl)-3-pyridinecarbonitrile IUPAC Name: 2-amino-6-(3-methoxyphenyl)-4-(4-octoxyphenyl)pyridine-3-carbonitrile Traditional Name: 2-amino-6-(3-methoxyphenyl)-4-(4-octoxyphenyl)nicotinonitrile Formula: C27H31N3O2 MolecularWeight: 429.55394

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H31N3O2/c1-3-4-5-6-7-8-16-32-22-14-12-20(13-15-22)24-18-26(30-27(29)25(24)19-28)21-10-9-11-23(17-21)31-2/h9-15,17-18H,3-8,16H2,1-2H3,(H2,29,30)