5-(7-methylnonoxy)-2-(1-octoxy-4-phenyl-cyclohexa-2,5-dien-1-yl)pyrimidine

Systemtic Name: 5-(7-methylnonoxy)-2-(1-octoxy-4-phenyl-cyclohexa-2,5-dien-1-yl)pyrimidine Openeye Name: 5-(7-methylnonoxy)-2-(1-octoxy-4-phenyl-cyclohexa-2,5-dien-1-yl)pyrimidine CAS Name: 5-(7-methylnonoxy)-2-(1-octoxy-4-phenyl-1-cyclohexa-2,5-dienyl)pyrimidine IUPAC Name: 5-(7-methylnonoxy)-2-(1-octoxy-4-phenylcyclohexa-2,5-dien-1-yl)pyrimidine Traditional Name: 5-(7-methylnonoxy)-2-(1-octoxy-4-phenyl-cyclohexa-2,5-dien-1-yl)pyrimidine Formula: C34H50N2O2 MolecularWeight: 518.773

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1(C=CC(C=C1)C2=CC=CC=C2)C3=NC=C(C=N3)OCCCCCCC(C)CC

Isomeric SMILES

CCCCCCCCOC1(C=CC(C=C1)C2=CC=CC=C2)C3=NC=C(C=N3)OCCCCCCC(C)CC

InChI

InChI=1S/C34H50N2O2/c1-4-6-7-8-10-17-26-38-34(23-21-31(22-24-34)30-19-14-12-15-20-30)33-35-27-32(28-36-33)37-25-16-11-9-13-18-29(3)5-2/h12,14-15,19-24,27-29,31H,4-11,13,16-18,25-26H2,1-3H3