4,6-bis(chloranyl)-2-(4-decylphenyl)-5-(3-fluoranylnonyl)pyrimidine

Systemtic Name: 4,6-bis(chloranyl)-2-(4-decylphenyl)-5-(3-fluoranylnonyl)pyrimidine Openeye Name: 4,6-dichloro-2-(4-decylphenyl)-5-(3-fluorononyl)pyrimidine CAS Name: 4,6-dichloro-2-(4-decylphenyl)-5-(3-fluorononyl)pyrimidine IUPAC Name: 4,6-dichloro-2-(4-decylphenyl)-5-(3-fluorononyl)pyrimidine Traditional Name: 4,6-dichloro-2-(4-decylphenyl)-5-(3-fluorononyl)pyrimidine Formula: C29H43Cl2FN2 MolecularWeight: 509.569523

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1=CC=C(C=C1)C2=NC(=C(C(=N2)Cl)CCC(CCCCCC)F)Cl

Isomeric SMILES

CCCCCCCCCCC1=CC=C(C=C1)C2=NC(=C(C(=N2)Cl)CCC(CCCCCC)F)Cl

InChI

InChI=1S/C29H43Cl2FN2/c1-3-5-7-9-10-11-12-13-15-23-17-19-24(20-18-23)29-33-27(30)26(28(31)34-29)22-21-25(32)16-14-8-6-4-2/h17-20,25H,3-16,21-22H2,1-2H3