2-(1-hexyl-4-phenyl-cyclohexa-2,5-dien-1-yl)-5-octan-2-yloxy-pyrimidine

Systemtic Name: 2-(1-hexyl-4-phenyl-cyclohexa-2,5-dien-1-yl)-5-octan-2-yloxy-pyrimidine Openeye Name: 2-(1-hexyl-4-phenyl-cyclohexa-2,5-dien-1-yl)-5-(1-methylheptoxy)pyrimidine CAS Name: 2-(1-hexyl-4-phenyl-1-cyclohexa-2,5-dienyl)-5-octan-2-yloxypyrimidine IUPAC Name: 2-(1-hexyl-4-phenylcyclohexa-2,5-dien-1-yl)-5-octan-2-yloxypyrimidine Traditional Name: 2-(1-hexyl-4-phenyl-cyclohexa-2,5-dien-1-yl)-5-(1-methylheptoxy)pyrimidine Formula: C30H42N2O MolecularWeight: 446.66728

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)OC1=CN=C(N=C1)C2(C=CC(C=C2)C3=CC=CC=C3)CCCCCC

Isomeric SMILES

CCCCCCC(C)OC1=CN=C(N=C1)C2(C=CC(C=C2)C3=CC=CC=C3)CCCCCC

InChI

InChI=1S/C30H42N2O/c1-4-6-8-11-15-25(3)33-28-23-31-29(32-24-28)30(20-14-9-7-5-2)21-18-27(19-22-30)26-16-12-10-13-17-26/h10,12-13,16-19,21-25,27H,4-9,11,14-15,20H2,1-3H3