2-[1,2-bis(fluoranyl)-4-phenyl-cyclohexa-2,5-dien-1-yl]-5-but-3-enyl-pyrimidine

Systemtic Name: 2-[1,2-bis(fluoranyl)-4-phenyl-cyclohexa-2,5-dien-1-yl]-5-but-3-enyl-pyrimidine Openeye Name: 5-but-3-enyl-2-(1,2-difluoro-4-phenyl-cyclohexa-2,5-dien-1-yl)pyrimidine CAS Name: 5-but-3-enyl-2-(1,2-difluoro-4-phenyl-1-cyclohexa-2,5-dienyl)pyrimidine IUPAC Name: 5-but-3-enyl-2-(1,2-difluoro-4-phenylcyclohexa-2,5-dien-1-yl)pyrimidine Traditional Name: 5-but-3-enyl-2-(1,2-difluoro-4-phenyl-cyclohexa-2,5-dien-1-yl)pyrimidine Formula: C20H18F2N2 MolecularWeight: 324.367126

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Descriptors Computed from Structure

Canonical SMILES:

C=CCCC1=CN=C(N=C1)C2(C=CC(C=C2F)C3=CC=CC=C3)F

Isomeric SMILES

C=CCCC1=CN=C(N=C1)C2(C=CC(C=C2F)C3=CC=CC=C3)F

InChI

InChI=1S/C20H18F2N2/c1-2-3-7-15-13-23-19(24-14-15)20(22)11-10-17(12-18(20)21)16-8-5-4-6-9-16/h2,4-6,8-14,17H,1,3,7H2