methyl 4-[4,6-bis(chloranyl)-2-pyrimidin-2-yl-pyrimidin-5-yl]oxy-3-propyl-benzoate

Systemtic Name: methyl 4-[4,6-bis(chloranyl)-2-pyrimidin-2-yl-pyrimidin-5-yl]oxy-3-propyl-benzoate Openeye Name: methyl 4-(4,6-dichloro-2-pyrimidin-2-yl-pyrimidin-5-yl)oxy-3-propyl-benzoate CAS Name: 4-[[4,6-dichloro-2-(2-pyrimidinyl)-5-pyrimidinyl]oxy]-3-propylbenzoic acid methyl ester IUPAC Name: methyl 4-(4,6-dichloro-2-pyrimidin-2-ylpyrimidin-5-yl)oxy-3-propylbenzoate Traditional Name: 4-[4,6-dichloro-2-(2-pyrimidyl)pyrimidin-5-yl]oxy-3-propyl-benzoic acid methyl ester Formula: C19H16Cl2N4O3 MolecularWeight: 419.26134

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1)C(=O)OC)OC2=C(N=C(N=C2Cl)C3=NC=CC=N3)Cl

Isomeric SMILES

CCCC1=C(C=CC(=C1)C(=O)OC)OC2=C(N=C(N=C2Cl)C3=NC=CC=N3)Cl

InChI

InChI=1S/C19H16Cl2N4O3/c1-3-5-11-10-12(19(26)27-2)6-7-13(11)28-14-15(20)24-18(25-16(14)21)17-22-8-4-9-23-17/h4,6-10H,3,5H2,1-2H3