2-azanyl-6-(4-ethoxyphenyl)-4-(4-heptoxyphenyl)pyridine-3-carbonitrile

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C2=CC(=NC(=C2C#N)N)C3=CC=C(C=C3)OCC

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C2=CC(=NC(=C2C#N)N)C3=CC=C(C=C3)OCC

InChI

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