2-azanyl-6-(3,4-dimethoxyphenyl)-4-(4-hexoxyphenyl)pyridine-3-carbonitrile

Systemtic Name: 2-azanyl-6-(3,4-dimethoxyphenyl)-4-(4-hexoxyphenyl)pyridine-3-carbonitrile Openeye Name: 2-amino-6-(3,4-dimethoxyphenyl)-4-(4-hexoxyphenyl)pyridine-3-carbonitrile CAS Name: 2-amino-6-(3,4-dimethoxyphenyl)-4-(4-hexoxyphenyl)-3-pyridinecarbonitrile IUPAC Name: 2-amino-6-(3,4-dimethoxyphenyl)-4-(4-hexoxyphenyl)pyridine-3-carbonitrile Traditional Name: 2-amino-6-(3,4-dimethoxyphenyl)-4-(4-hexoxyphenyl)nicotinonitrile Formula: C26H29N3O3 MolecularWeight: 431.52676

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C2=CC(=NC(=C2C#N)N)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C2=CC(=NC(=C2C#N)N)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C26H29N3O3/c1-4-5-6-7-14-32-20-11-8-18(9-12-20)21-16-23(29-26(28)22(21)17-27)19-10-13-24(30-2)25(15-19)31-3/h8-13,15-16H,4-7,14H2,1-3H3,(H2,28,29)