2-(4-butylphenyl)-5-heptoxy-pyrimidine

Systemtic Name: 2-(4-butylphenyl)-5-heptoxy-pyrimidine Openeye Name: 2-(4-butylphenyl)-5-heptoxy-pyrimidine CAS Name: 2-(4-butylphenyl)-5-heptoxypyrimidine IUPAC Name: 2-(4-butylphenyl)-5-heptoxypyrimidine Traditional Name: 2-(4-butylphenyl)-5-heptoxy-pyrimidine Formula: C21H30N2O MolecularWeight: 326.4757

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)CCCC

Isomeric SMILES

CCCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)CCCC

InChI

InChI=1S/C21H30N2O/c1-3-5-7-8-9-15-24-20-16-22-21(23-17-20)19-13-11-18(12-14-19)10-6-4-2/h11-14,16-17H,3-10,15H2,1-2H3