5-heptoxy-2-[1-(6-methyloctoxy)-4-phenyl-cyclohexa-2,5-dien-1-yl]pyrimidine

Systemtic Name: 5-heptoxy-2-[1-(6-methyloctoxy)-4-phenyl-cyclohexa-2,5-dien-1-yl]pyrimidine Openeye Name: 5-heptoxy-2-[1-(6-methyloctoxy)-4-phenyl-cyclohexa-2,5-dien-1-yl]pyrimidine CAS Name: 5-heptoxy-2-[1-(6-methyloctoxy)-4-phenyl-1-cyclohexa-2,5-dienyl]pyrimidine IUPAC Name: 5-heptoxy-2-[1-(6-methyloctoxy)-4-phenylcyclohexa-2,5-dien-1-yl]pyrimidine Traditional Name: 5-heptoxy-2-[1-(6-methyloctoxy)-4-phenyl-cyclohexa-2,5-dien-1-yl]pyrimidine Formula: C32H46N2O2 MolecularWeight: 490.71984

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CN=C(N=C1)C2(C=CC(C=C2)C3=CC=CC=C3)OCCCCCC(C)CC

Isomeric SMILES

CCCCCCCOC1=CN=C(N=C1)C2(C=CC(C=C2)C3=CC=CC=C3)OCCCCCC(C)CC

InChI

InChI=1S/C32H46N2O2/c1-4-6-7-8-14-23-35-30-25-33-31(34-26-30)32(36-24-15-10-11-16-27(3)5-2)21-19-29(20-22-32)28-17-12-9-13-18-28/h9,12-13,17-22,25-27,29H,4-8,10-11,14-16,23-24H2,1-3H3