2-[1-(2-ethoxypropoxy)-4-phenyl-cyclohexa-2,5-dien-1-yl]-5-hexoxy-pyrimidine

Systemtic Name: 2-[1-(2-ethoxypropoxy)-4-phenyl-cyclohexa-2,5-dien-1-yl]-5-hexoxy-pyrimidine Openeye Name: 2-[1-(2-ethoxypropoxy)-4-phenyl-cyclohexa-2,5-dien-1-yl]-5-hexoxy-pyrimidine CAS Name: 2-[1-(2-ethoxypropoxy)-4-phenyl-1-cyclohexa-2,5-dienyl]-5-hexoxypyrimidine IUPAC Name: 2-[1-(2-ethoxypropoxy)-4-phenylcyclohexa-2,5-dien-1-yl]-5-hexoxypyrimidine Traditional Name: 2-[1-(2-ethoxypropoxy)-4-phenyl-cyclohexa-2,5-dien-1-yl]-5-hexoxy-pyrimidine Formula: C27H36N2O3 MolecularWeight: 436.58634

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CN=C(N=C1)C2(C=CC(C=C2)C3=CC=CC=C3)OCC(C)OCC

Isomeric SMILES

CCCCCCOC1=CN=C(N=C1)C2(C=CC(C=C2)C3=CC=CC=C3)OCC(C)OCC

InChI

InChI=1S/C27H36N2O3/c1-4-6-7-11-18-31-25-19-28-26(29-20-25)27(32-21-22(3)30-5-2)16-14-24(15-17-27)23-12-9-8-10-13-23/h8-10,12-17,19-20,22,24H,4-7,11,18,21H2,1-3H3