methyl 3-(1,3-benzodioxol-5-yl)-6-chloranyl-2-methyl-4H-pyrimidine-5-carboxylate

Systemtic Name: methyl 3-(1,3-benzodioxol-5-yl)-6-chloranyl-2-methyl-4H-pyrimidine-5-carboxylate Openeye Name: methyl 3-(1,3-benzodioxol-5-yl)-6-chloro-2-methyl-4H-pyrimidine-5-carboxylate CAS Name: 3-(1,3-benzodioxol-5-yl)-6-chloro-2-methyl-4H-pyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl 3-(1,3-benzodioxol-5-yl)-6-chloro-2-methyl-4H-pyrimidine-5-carboxylate Traditional Name: 3-(1,3-benzodioxol-5-yl)-6-chloro-2-methyl-4H-pyrimidine-5-carboxylic acid methyl ester Formula: C14H13ClN2O4 MolecularWeight: 308.71702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(CN1C2=CC3=C(C=C2)OCO3)C(=O)OC)Cl

Isomeric SMILES

CC1=NC(=C(CN1C2=CC3=C(C=C2)OCO3)C(=O)OC)Cl

InChI

InChI=1S/C14H13ClN2O4/c1-8-16-13(15)10(14(18)19-2)6-17(8)9-3-4-11-12(5-9)21-7-20-11/h3-5H,6-7H2,1-2H3