methyl 4-[(2-butyl-6-chloranyl-5-ethyl-pyrimidin-4-yl)methyl]benzoate

Systemtic Name: methyl 4-[(2-butyl-6-chloranyl-5-ethyl-pyrimidin-4-yl)methyl]benzoate Openeye Name: methyl 4-[(2-butyl-6-chloro-5-ethyl-pyrimidin-4-yl)methyl]benzoate CAS Name: 4-[(2-butyl-6-chloro-5-ethyl-4-pyrimidinyl)methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(2-butyl-6-chloro-5-ethylpyrimidin-4-yl)methyl]benzoate Traditional Name: 4-[(2-butyl-6-chloro-5-ethyl-pyrimidin-4-yl)methyl]benzoic acid methyl ester Formula: C19H23ClN2O2 MolecularWeight: 346.85112

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(C(=N1)Cl)CC)CC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CCCCC1=NC(=C(C(=N1)Cl)CC)CC2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C19H23ClN2O2/c1-4-6-7-17-21-16(15(5-2)18(20)22-17)12-13-8-10-14(11-9-13)19(23)24-3/h8-11H,4-7,12H2,1-3H3