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

Systemtic Name: dimethyl 4-(3-bromanyl-4-methyl-phenyl)-1-(oxolan-2-ylmethyl)-4H-pyridine-3,5-dicarboxylate Openeye Name: dimethyl 4-(3-bromo-4-methyl-phenyl)-1-(tetrahydrofuran-2-ylmethyl)-4H-pyridine-3,5-dicarboxylate CAS Name: 4-(3-bromo-4-methylphenyl)-1-(2-oxolanylmethyl)-4H-pyridine-3,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 4-(3-bromo-4-methylphenyl)-1-(oxolan-2-ylmethyl)-4H-pyridine-3,5-dicarboxylate Traditional Name: 4-(3-bromo-4-methyl-phenyl)-1-(tetrahydrofurfuryl)-4H-pyridine-3,5-dicarboxylic acid dimethyl ester Formula: C21H24BrNO5 MolecularWeight: 450.32296

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2C(=CN(C=C2C(=O)OC)CC3CCCO3)C(=O)OC)Br

Isomeric SMILES

CC1=C(C=C(C=C1)C2C(=CN(C=C2C(=O)OC)CC3CCCO3)C(=O)OC)Br

InChI

InChI=1S/C21H24BrNO5/c1-13-6-7-14(9-18(13)22)19-16(20(24)26-2)11-23(10-15-5-4-8-28-15)12-17(19)21(25)27-3/h6-7,9,11-12,15,19H,4-5,8,10H2,1-3H3