5-decyl-2-[4-(octan-2-yloxymethyl)phenyl]pyrimidine

Systemtic Name: 5-decyl-2-[4-(octan-2-yloxymethyl)phenyl]pyrimidine Openeye Name: 5-decyl-2-[4-(1-methylheptoxymethyl)phenyl]pyrimidine CAS Name: 5-decyl-2-[4-(octan-2-yloxymethyl)phenyl]pyrimidine IUPAC Name: 5-decyl-2-[4-(octan-2-yloxymethyl)phenyl]pyrimidine Traditional Name: 5-decyl-2-[4-(1-methylheptoxymethyl)phenyl]pyrimidine Formula: C29H46N2O MolecularWeight: 438.68834

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)COC(C)CCCCCC

Isomeric SMILES

CCCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)COC(C)CCCCCC

InChI

InChI=1S/C29H46N2O/c1-4-6-8-10-11-12-13-15-17-27-22-30-29(31-23-27)28-20-18-26(19-21-28)24-32-25(3)16-14-9-7-5-2/h18-23,25H,4-17,24H2,1-3H3