1-butoxyethyl 4-(5-butylpyrimidin-2-yl)benzoate

Systemtic Name: 1-butoxyethyl 4-(5-butylpyrimidin-2-yl)benzoate Openeye Name: 1-butoxyethyl 4-(5-butylpyrimidin-2-yl)benzoate CAS Name: 4-(5-butyl-2-pyrimidinyl)benzoic acid 1-butoxyethyl ester IUPAC Name: 1-butoxyethyl 4-(5-butylpyrimidin-2-yl)benzoate Traditional Name: 4-(5-butylpyrimidin-2-yl)benzoic acid 1-butoxyethyl ester Formula: C21H28N2O3 MolecularWeight: 356.45862

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CN=C(N=C1)C2=CC=C(C=C2)C(=O)OC(C)OCCCC

Isomeric SMILES

CCCCC1=CN=C(N=C1)C2=CC=C(C=C2)C(=O)OC(C)OCCCC

InChI

InChI=1S/C21H28N2O3/c1-4-6-8-17-14-22-20(23-15-17)18-9-11-19(12-10-18)21(24)26-16(3)25-13-7-5-2/h9-12,14-16H,4-8,13H2,1-3H3