5-(2-hexoxypropoxy)-2-(1-octoxy-4-phenyl-cyclohexa-2,5-dien-1-yl)pyrimidine

Systemtic Name: 5-(2-hexoxypropoxy)-2-(1-octoxy-4-phenyl-cyclohexa-2,5-dien-1-yl)pyrimidine Openeye Name: 5-(2-hexoxypropoxy)-2-(1-octoxy-4-phenyl-cyclohexa-2,5-dien-1-yl)pyrimidine CAS Name: 5-(2-hexoxypropoxy)-2-(1-octoxy-4-phenyl-1-cyclohexa-2,5-dienyl)pyrimidine IUPAC Name: 5-(2-hexoxypropoxy)-2-(1-octoxy-4-phenylcyclohexa-2,5-dien-1-yl)pyrimidine Traditional Name: 5-(2-hexoxypropoxy)-2-(1-octoxy-4-phenyl-cyclohexa-2,5-dien-1-yl)pyrimidine Formula: C33H48N2O3 MolecularWeight: 520.74582

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1(C=CC(C=C1)C2=CC=CC=C2)C3=NC=C(C=N3)OCC(C)OCCCCCC

Isomeric SMILES

CCCCCCCCOC1(C=CC(C=C1)C2=CC=CC=C2)C3=NC=C(C=N3)OCC(C)OCCCCCC

InChI

InChI=1S/C33H48N2O3/c1-4-6-8-10-11-16-24-38-33(21-19-30(20-22-33)29-17-13-12-14-18-29)32-34-25-31(26-35-32)37-27-28(3)36-23-15-9-7-5-2/h12-14,17-22,25-26,28,30H,4-11,15-16,23-24,27H2,1-3H3