(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl 2-chloranyl-4,6-dimethyl-pyridine-3-carboxylate

Systemtic Name: (6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl 2-chloranyl-4,6-dimethyl-pyridine-3-carboxylate Openeye Name: (6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl 2-chloro-4,6-dimethyl-pyridine-3-carboxylate CAS Name: 2-chloro-4,6-dimethyl-3-pyridinecarboxylic acid (6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl ester IUPAC Name: (6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl 2-chloro-4,6-dimethylpyridine-3-carboxylate Traditional Name: 2-chloro-4,6-dimethyl-nicotinic acid (6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl ester Formula: C17H15BrClNO4 MolecularWeight: 412.6623

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1C(=O)OCC2=CC3=C(C=C2Br)OCCO3)Cl)C

Isomeric SMILES

CC1=CC(=NC(=C1C(=O)OCC2=CC3=C(C=C2Br)OCCO3)Cl)C

InChI

InChI=1S/C17H15BrClNO4/c1-9-5-10(2)20-16(19)15(9)17(21)24-8-11-6-13-14(7-12(11)18)23-4-3-22-13/h5-7H,3-4,8H2,1-2H3