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

Systemtic Name: 2-azanyl-6-(2-methoxyphenyl)-4-(4-octoxyphenyl)pyridine-3-carbonitrile Openeye Name: 2-amino-6-(2-methoxyphenyl)-4-(4-octoxyphenyl)pyridine-3-carbonitrile CAS Name: 2-amino-6-(2-methoxyphenyl)-4-(4-octoxyphenyl)-3-pyridinecarbonitrile IUPAC Name: 2-amino-6-(2-methoxyphenyl)-4-(4-octoxyphenyl)pyridine-3-carbonitrile Traditional Name: 2-amino-6-(2-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=C3OC

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C2=CC(=NC(=C2C#N)N)C3=CC=CC=C3OC

InChI

InChI=1S/C27H31N3O2/c1-3-4-5-6-7-10-17-32-21-15-13-20(14-16-21)23-18-25(30-27(29)24(23)19-28)22-11-8-9-12-26(22)31-2/h8-9,11-16,18H,3-7,10,17H2,1-2H3,(H2,29,30)