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

Systemtic Name: 2-[1-(2-decoxypropyl)-4-phenyl-cyclohexa-2,5-dien-1-yl]-5-hexoxy-pyrimidine Openeye Name: 2-[1-(2-decoxypropyl)-4-phenyl-cyclohexa-2,5-dien-1-yl]-5-hexoxy-pyrimidine CAS Name: 2-[1-(2-decoxypropyl)-4-phenyl-1-cyclohexa-2,5-dienyl]-5-hexoxypyrimidine IUPAC Name: 2-[1-(2-decoxypropyl)-4-phenylcyclohexa-2,5-dien-1-yl]-5-hexoxypyrimidine Traditional Name: 2-[1-(2-decoxypropyl)-4-phenyl-cyclohexa-2,5-dien-1-yl]-5-hexoxy-pyrimidine Formula: C35H52N2O2 MolecularWeight: 532.79958

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC(C)CC1(C=CC(C=C1)C2=CC=CC=C2)C3=NC=C(C=N3)OCCCCCC

Isomeric SMILES

CCCCCCCCCCOC(C)CC1(C=CC(C=C1)C2=CC=CC=C2)C3=NC=C(C=N3)OCCCCCC

InChI

InChI=1S/C35H52N2O2/c1-4-6-8-10-11-12-13-18-25-38-30(3)27-35(23-21-32(22-24-35)31-19-15-14-16-20-31)34-36-28-33(29-37-34)39-26-17-9-7-5-2/h14-16,19-24,28-30,32H,4-13,17-18,25-27H2,1-3H3