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

Systemtic Name: (6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl pyridine-4-carboxylate Openeye Name: (6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl pyridine-4-carboxylate CAS Name: 4-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 pyridine-4-carboxylate Traditional Name: isonicotinic acid (6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl ester Formula: C15H12BrNO4 MolecularWeight: 350.16408

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=C(C(=C2)Br)COC(=O)C3=CC=NC=C3

Isomeric SMILES

C1COC2=C(O1)C=C(C(=C2)Br)COC(=O)C3=CC=NC=C3

InChI

InChI=1S/C15H12BrNO4/c16-12-8-14-13(19-5-6-20-14)7-11(12)9-21-15(18)10-1-3-17-4-2-10/h1-4,7-8H,5-6,9H2