5-nonyl-4-[(1E,12E)-octadeca-1,12-dienoxy]-2-phenyl-pyrimidine

Systemtic Name: 5-nonyl-4-[(1E,12E)-octadeca-1,12-dienoxy]-2-phenyl-pyrimidine Openeye Name: 5-nonyl-4-[(1E,12E)-octadeca-1,12-dienoxy]-2-phenyl-pyrimidine CAS Name: 5-nonyl-4-[(1E,12E)-octadeca-1,12-dienoxy]-2-phenylpyrimidine IUPAC Name: 5-nonyl-4-[(1E,12E)-octadeca-1,12-dienoxy]-2-phenylpyrimidine Traditional Name: 5-nonyl-4-[(1E,12E)-octadeca-1,12-dienoxy]-2-phenyl-pyrimidine Formula: C37H58N2O MolecularWeight: 546.86922

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CN=C(N=C1OC=CCCCCCCCCCC=CCCCCC)C2=CC=CC=C2

Isomeric SMILES

CCCCCCCCCC1=CN=C(N=C1O/C=C/CCCCCCCCC/C=C/CCCCC)C2=CC=CC=C2

InChI

InChI=1S/C37H58N2O/c1-3-5-7-9-11-12-13-14-15-16-17-18-19-21-23-28-32-40-37-35(31-25-22-20-10-8-6-4-2)33-38-36(39-37)34-29-26-24-27-30-34/h11-12,24,26-30,32-33H,3-10,13-23,25,31H2,1-2H3/b12-11+,32-28+