5-(2-pentoxypropoxy)-2-(4-phenyl-1-undecyl-cyclohexa-2,5-dien-1-yl)pyrimidine

Systemtic Name: 5-(2-pentoxypropoxy)-2-(4-phenyl-1-undecyl-cyclohexa-2,5-dien-1-yl)pyrimidine Openeye Name: 5-(2-pentoxypropoxy)-2-(4-phenyl-1-undecyl-cyclohexa-2,5-dien-1-yl)pyrimidine CAS Name: 5-(2-pentoxypropoxy)-2-(4-phenyl-1-undecyl-1-cyclohexa-2,5-dienyl)pyrimidine IUPAC Name: 5-(2-pentoxypropoxy)-2-(4-phenyl-1-undecylcyclohexa-2,5-dien-1-yl)pyrimidine Traditional Name: 5-(2-amoxypropoxy)-2-(4-phenyl-1-undecyl-cyclohexa-2,5-dien-1-yl)pyrimidine Formula: C35H52N2O2 MolecularWeight: 532.79958

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC1(C=CC(C=C1)C2=CC=CC=C2)C3=NC=C(C=N3)OCC(C)OCCCCC

Isomeric SMILES

CCCCCCCCCCCC1(C=CC(C=C1)C2=CC=CC=C2)C3=NC=C(C=N3)OCC(C)OCCCCC

InChI

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