2-[[3-methyl-2-(4-nonylphenoxy)phenyl]methyl]pyrazine

Systemtic Name: 2-[[3-methyl-2-(4-nonylphenoxy)phenyl]methyl]pyrazine Openeye Name: 2-[[3-methyl-2-(4-nonylphenoxy)phenyl]methyl]pyrazine CAS Name: 2-[[3-methyl-2-(4-nonylphenoxy)phenyl]methyl]pyrazine IUPAC Name: 2-[[3-methyl-2-(4-nonylphenoxy)phenyl]methyl]pyrazine Traditional Name: 2-[3-methyl-2-(4-nonylphenoxy)benzyl]pyrazine Formula: C27H34N2O MolecularWeight: 402.57166

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CC=C(C=C1)OC2=C(C=CC=C2CC3=NC=CN=C3)C

Isomeric SMILES

CCCCCCCCCC1=CC=C(C=C1)OC2=C(C=CC=C2CC3=NC=CN=C3)C

InChI

InChI=1S/C27H34N2O/c1-3-4-5-6-7-8-9-12-23-14-16-26(17-15-23)30-27-22(2)11-10-13-24(27)20-25-21-28-18-19-29-25/h10-11,13-19,21H,3-9,12,20H2,1-2H3