5-(2-butoxypropoxy)-2-(1-pentyl-4-phenyl-cyclohexa-2,5-dien-1-yl)pyrimidine

Systemtic Name: 5-(2-butoxypropoxy)-2-(1-pentyl-4-phenyl-cyclohexa-2,5-dien-1-yl)pyrimidine Openeye Name: 5-(2-butoxypropoxy)-2-(1-pentyl-4-phenyl-cyclohexa-2,5-dien-1-yl)pyrimidine CAS Name: 5-(2-butoxypropoxy)-2-(1-pentyl-4-phenyl-1-cyclohexa-2,5-dienyl)pyrimidine IUPAC Name: 5-(2-butoxypropoxy)-2-(1-pentyl-4-phenylcyclohexa-2,5-dien-1-yl)pyrimidine Traditional Name: 2-(1-amyl-4-phenyl-cyclohexa-2,5-dien-1-yl)-5-(2-butoxypropoxy)pyrimidine Formula: C28H38N2O2 MolecularWeight: 434.61352

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1(C=CC(C=C1)C2=CC=CC=C2)C3=NC=C(C=N3)OCC(C)OCCCC

Isomeric SMILES

CCCCCC1(C=CC(C=C1)C2=CC=CC=C2)C3=NC=C(C=N3)OCC(C)OCCCC

InChI

InChI=1S/C28H38N2O2/c1-4-6-11-16-28(17-14-25(15-18-28)24-12-9-8-10-13-24)27-29-20-26(21-30-27)32-22-23(3)31-19-7-5-2/h8-10,12-15,17-18,20-21,23,25H,4-7,11,16,19,22H2,1-3H3