2-azanyl-4-(4-hexoxyphenyl)-6-[4-(2-methylpropyl)phenyl]pyridine-3-carbonitrile

Systemtic Name: 2-azanyl-4-(4-hexoxyphenyl)-6-[4-(2-methylpropyl)phenyl]pyridine-3-carbonitrile Openeye Name: 2-amino-4-(4-hexoxyphenyl)-6-(4-isobutylphenyl)pyridine-3-carbonitrile CAS Name: 2-amino-4-(4-hexoxyphenyl)-6-[4-(2-methylpropyl)phenyl]-3-pyridinecarbonitrile IUPAC Name: 2-amino-4-(4-hexoxyphenyl)-6-[4-(2-methylpropyl)phenyl]pyridine-3-carbonitrile Traditional Name: 2-amino-4-(4-hexoxyphenyl)-6-(4-isobutylphenyl)nicotinonitrile Formula: C28H33N3O MolecularWeight: 427.58112

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H33N3O/c1-4-5-6-7-16-32-24-14-12-22(13-15-24)25-18-27(31-28(30)26(25)19-29)23-10-8-21(9-11-23)17-20(2)3/h8-15,18,20H,4-7,16-17H2,1-3H3,(H2,30,31)