methyl 4-(5-decylpyrimidin-2-yl)benzoate

Systemtic Name: methyl 4-(5-decylpyrimidin-2-yl)benzoate Openeye Name: methyl 4-(5-decylpyrimidin-2-yl)benzoate CAS Name: 4-(5-decyl-2-pyrimidinyl)benzoic acid methyl ester IUPAC Name: methyl 4-(5-decylpyrimidin-2-yl)benzoate Traditional Name: 4-(5-decylpyrimidin-2-yl)benzoic acid methyl ester Formula: C22H30N2O2 MolecularWeight: 354.4858

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CCCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C22H30N2O2/c1-3-4-5-6-7-8-9-10-11-18-16-23-21(24-17-18)19-12-14-20(15-13-19)22(25)26-2/h12-17H,3-11H2,1-2H3