2-(4-octoxyphenyl)pyrimidine-5-carbonitrile

Systemtic Name: 2-(4-octoxyphenyl)pyrimidine-5-carbonitrile Openeye Name: 2-(4-octoxyphenyl)pyrimidine-5-carbonitrile CAS Name: 2-(4-octoxyphenyl)-5-pyrimidinecarbonitrile IUPAC Name: 2-(4-octoxyphenyl)pyrimidine-5-carbonitrile Traditional Name: 2-(4-octoxyphenyl)pyrimidine-5-carbonitrile Formula: C19H23N3O MolecularWeight: 309.40542

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C2=NC=C(C=N2)C#N

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C2=NC=C(C=N2)C#N

InChI

InChI=1S/C19H23N3O/c1-2-3-4-5-6-7-12-23-18-10-8-17(9-11-18)19-21-14-16(13-20)15-22-19/h8-11,14-15H,2-7,12H2,1H3