6-(2,2-diphenylethenyl)-2-methyl-5-octyl-1H-pyrimidin-4-one

Systemtic Name: 6-(2,2-diphenylethenyl)-2-methyl-5-octyl-1H-pyrimidin-4-one Openeye Name: 6-(2,2-diphenylvinyl)-2-methyl-5-octyl-1H-pyrimidin-4-one CAS Name: 6-(2,2-diphenylethenyl)-2-methyl-5-octyl-1H-pyrimidin-4-one IUPAC Name: 6-(2,2-diphenylethenyl)-2-methyl-5-octyl-1H-pyrimidin-4-one Traditional Name: 6-(2,2-diphenylvinyl)-2-methyl-5-octyl-1H-pyrimidin-4-one Formula: C27H32N2O MolecularWeight: 400.55578

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=C(NC(=NC1=O)C)C=C(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCCCCCCCC1=C(NC(=NC1=O)C)C=C(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C27H32N2O/c1-3-4-5-6-7-14-19-24-26(28-21(2)29-27(24)30)20-25(22-15-10-8-11-16-22)23-17-12-9-13-18-23/h8-13,15-18,20H,3-7,14,19H2,1-2H3,(H,28,29,30)