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2-butyl-4-chloranyl-5-ethyl-6-(phenylmethyl)pyrimidine ethanoate

2-butyl-4-chloranyl-5-ethyl-6-(phenylmethyl)pyrimidine ethanoate

Systemtic Name:2-butyl-4-chloranyl-5-ethyl-6-(phenylmethyl)pyrimidine ethanoate
Openeye Name:4-benzyl-2-butyl-6-chloro-5-ethyl-pyrimidine acetate
CAS Name:2-butyl-4-chloro-5-ethyl-6-(phenylmethyl)pyrimidine acetate
IUPAC Name:4-benzyl-2-butyl-6-chloro-5-ethylpyrimidine acetate
Traditional Name:4-benzyl-2-butyl-6-chloro-5-ethyl-pyrimidine acetate
Formula: C19H24ClN2O2-
MolecularWeight: 347.85906
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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(C(=N1)Cl)CC)CC2=CC=CC=C2.CC(=O)[O-]


Isomeric SMILES

CCCCC1=NC(=C(C(=N1)Cl)CC)CC2=CC=CC=C2.CC(=O)[O-]


InChI

InChI=1S/C17H21ClN2.C2H4O2/c1-3-5-11-16-19-15(14(4-2)17(18)20-16)12-13-9-7-6-8-10-13;1-2(3)4/h6-10H,3-5,11-12H2,1-2H3;1H3,(H,3,4)/p-1


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