5-heptyl-2-[4-[4-[(8S)-8-methyldecoxy]phenyl]phenyl]pyrimidine

Systemtic Name: 5-heptyl-2-[4-[4-[(8S)-8-methyldecoxy]phenyl]phenyl]pyrimidine Openeye Name: 5-heptyl-2-[4-[4-[(8S)-8-methyldecoxy]phenyl]phenyl]pyrimidine CAS Name: 5-heptyl-2-[4-[4-[(8S)-8-methyldecoxy]phenyl]phenyl]pyrimidine IUPAC Name: 5-heptyl-2-[4-[4-[(8S)-8-methyldecoxy]phenyl]phenyl]pyrimidine Traditional Name: 5-heptyl-2-[4-[4-[(8S)-8-methyldecoxy]phenyl]phenyl]pyrimidine Formula: C34H48N2O MolecularWeight: 500.75772

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)C3=CC=C(C=C3)OCCCCCCCC(C)CC

Isomeric SMILES

CCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)C3=CC=C(C=C3)OCCCCCCC[C@@H](C)CC

InChI

InChI=1S/C34H48N2O/c1-4-6-7-9-13-16-29-26-35-34(36-27-29)32-19-17-30(18-20-32)31-21-23-33(24-22-31)37-25-14-11-8-10-12-15-28(3)5-2/h17-24,26-28H,4-16,25H2,1-3H3/t28-/m0/s1