dimethyl 4-(6-bromanyl-1,3-benzodioxol-5-yl)-1-propyl-4H-pyridine-3,5-dicarboxylate

Systemtic Name: dimethyl 4-(6-bromanyl-1,3-benzodioxol-5-yl)-1-propyl-4H-pyridine-3,5-dicarboxylate Openeye Name: dimethyl 4-(6-bromo-1,3-benzodioxol-5-yl)-1-propyl-4H-pyridine-3,5-dicarboxylate CAS Name: 4-(6-bromo-1,3-benzodioxol-5-yl)-1-propyl-4H-pyridine-3,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 4-(6-bromo-1,3-benzodioxol-5-yl)-1-propyl-4H-pyridine-3,5-dicarboxylate Traditional Name: 4-(6-bromo-1,3-benzodioxol-5-yl)-1-propyl-4H-pyridine-3,5-dicarboxylic acid dimethyl ester Formula: C19H20BrNO6 MolecularWeight: 438.2692

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=C(C(C(=C1)C(=O)OC)C2=CC3=C(C=C2Br)OCO3)C(=O)OC

Isomeric SMILES

CCCN1C=C(C(C(=C1)C(=O)OC)C2=CC3=C(C=C2Br)OCO3)C(=O)OC

InChI

InChI=1S/C19H20BrNO6/c1-4-5-21-8-12(18(22)24-2)17(13(9-21)19(23)25-3)11-6-15-16(7-14(11)20)27-10-26-15/h6-9,17H,4-5,10H2,1-3H3