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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CN=C(N=C1)C2(C=CC(C=C2)C3=CC=CC=C3)OCCCCCCC(C)CC

Isomeric SMILES

CCCCCCCCOC1=CN=C(N=C1)C2(C=CC(C=C2)C3=CC=CC=C3)OCCCCCCC(C)CC

InChI

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