2-[4-(4-pentoxyphenyl)phenyl]pyrimidine

Systemtic Name: 2-[4-(4-pentoxyphenyl)phenyl]pyrimidine Openeye Name: 2-[4-(4-pentoxyphenyl)phenyl]pyrimidine CAS Name: 2-[4-(4-pentoxyphenyl)phenyl]pyrimidine IUPAC Name: 2-[4-(4-pentoxyphenyl)phenyl]pyrimidine Traditional Name: 2-[4-(4-amoxyphenyl)phenyl]pyrimidine Formula: C21H22N2O MolecularWeight: 318.41218

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C3=NC=CC=N3

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C3=NC=CC=N3

InChI

InChI=1S/C21H22N2O/c1-2-3-4-16-24-20-12-10-18(11-13-20)17-6-8-19(9-7-17)21-22-14-5-15-23-21/h5-15H,2-4,16H2,1H3