4-nonan-5-yl-2-[6-(4-octylcyclohexyl)cyclohexa-1,3-dien-1-yl]pyrimidine

Systemtic Name: 4-nonan-5-yl-2-[6-(4-octylcyclohexyl)cyclohexa-1,3-dien-1-yl]pyrimidine Openeye Name: 4-(1-butylpentyl)-2-[6-(4-octylcyclohexyl)cyclohexa-1,3-dien-1-yl]pyrimidine CAS Name: 4-nonan-5-yl-2-[6-(4-octylcyclohexyl)-1-cyclohexa-1,3-dienyl]pyrimidine IUPAC Name: 4-nonan-5-yl-2-[6-(4-octylcyclohexyl)cyclohexa-1,3-dien-1-yl]pyrimidine Traditional Name: 4-(1-butylpentyl)-2-[6-(4-octylcyclohexyl)cyclohexa-1,3-dien-1-yl]pyrimidine Formula: C33H54N2 MolecularWeight: 478.79526

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1CCC(CC1)C2CC=CC=C2C3=NC=CC(=N3)C(CCCC)CCCC

Isomeric SMILES

CCCCCCCCC1CCC(CC1)C2CC=CC=C2C3=NC=CC(=N3)C(CCCC)CCCC

InChI

InChI=1S/C33H54N2/c1-4-7-10-11-12-13-16-27-21-23-28(24-22-27)30-19-14-15-20-31(30)33-34-26-25-32(35-33)29(17-8-5-2)18-9-6-3/h14-15,20,25-30H,4-13,16-19,21-24H2,1-3H3