(4-bromanyl-2,5-dimethoxy-phenyl)methyl 2-chloranyl-4,6-dimethyl-pyridine-3-carboxylate

Systemtic Name: (4-bromanyl-2,5-dimethoxy-phenyl)methyl 2-chloranyl-4,6-dimethyl-pyridine-3-carboxylate Openeye Name: (4-bromo-2,5-dimethoxy-phenyl)methyl 2-chloro-4,6-dimethyl-pyridine-3-carboxylate CAS Name: 2-chloro-4,6-dimethyl-3-pyridinecarboxylic acid (4-bromo-2,5-dimethoxyphenyl)methyl ester IUPAC Name: (4-bromo-2,5-dimethoxyphenyl)methyl 2-chloro-4,6-dimethylpyridine-3-carboxylate Traditional Name: 2-chloro-4,6-dimethyl-nicotinic acid (4-bromo-2,5-dimethoxy-benzyl) ester Formula: C17H17BrClNO4 MolecularWeight: 414.67818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1C(=O)OCC2=CC(=C(C=C2OC)Br)OC)Cl)C

Isomeric SMILES

CC1=CC(=NC(=C1C(=O)OCC2=CC(=C(C=C2OC)Br)OC)Cl)C

InChI

InChI=1S/C17H17BrClNO4/c1-9-5-10(2)20-16(19)15(9)17(21)24-8-11-6-14(23-4)12(18)7-13(11)22-3/h5-7H,8H2,1-4H3