4-[5-[(4-heptylphenyl)methoxy]pyrazin-2-yl]benzenecarbonitrile

Systemtic Name: 4-[5-[(4-heptylphenyl)methoxy]pyrazin-2-yl]benzenecarbonitrile Openeye Name: 4-[5-[(4-heptylphenyl)methoxy]pyrazin-2-yl]benzonitrile CAS Name: 4-[5-[(4-heptylphenyl)methoxy]-2-pyrazinyl]benzonitrile IUPAC Name: 4-[5-[(4-heptylphenyl)methoxy]pyrazin-2-yl]benzonitrile Traditional Name: 4-[5-(4-heptylbenzyl)oxypyrazin-2-yl]benzonitrile Formula: C25H27N3O MolecularWeight: 385.50138

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)COC2=NC=C(N=C2)C3=CC=C(C=C3)C#N

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)COC2=NC=C(N=C2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C25H27N3O/c1-2-3-4-5-6-7-20-8-10-22(11-9-20)19-29-25-18-27-24(17-28-25)23-14-12-21(16-26)13-15-23/h8-15,17-18H,2-7,19H2,1H3