dimethyl 4-(3-bromanyl-4-methoxy-phenyl)-1-(oxolan-2-ylmethyl)-4H-pyridine-3,5-dicarboxylate

Systemtic Name: dimethyl 4-(3-bromanyl-4-methoxy-phenyl)-1-(oxolan-2-ylmethyl)-4H-pyridine-3,5-dicarboxylate Openeye Name: dimethyl 4-(3-bromo-4-methoxy-phenyl)-1-(tetrahydrofuran-2-ylmethyl)-4H-pyridine-3,5-dicarboxylate CAS Name: 4-(3-bromo-4-methoxyphenyl)-1-(2-oxolanylmethyl)-4H-pyridine-3,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 4-(3-bromo-4-methoxyphenyl)-1-(oxolan-2-ylmethyl)-4H-pyridine-3,5-dicarboxylate Traditional Name: 4-(3-bromo-4-methoxy-phenyl)-1-(tetrahydrofurfuryl)-4H-pyridine-3,5-dicarboxylic acid dimethyl ester Formula: C21H24BrNO6 MolecularWeight: 466.32236

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2C(=CN(C=C2C(=O)OC)CC3CCCO3)C(=O)OC)Br

Isomeric SMILES

COC1=C(C=C(C=C1)C2C(=CN(C=C2C(=O)OC)CC3CCCO3)C(=O)OC)Br

InChI

InChI=1S/C21H24BrNO6/c1-26-18-7-6-13(9-17(18)22)19-15(20(24)27-2)11-23(10-14-5-4-8-29-14)12-16(19)21(25)28-3/h6-7,9,11-12,14,19H,4-5,8,10H2,1-3H3