diethyl 4-(5-bromanyl-2-methoxy-phenyl)-1-propan-2-yl-4H-pyridine-3,5-dicarboxylate

Systemtic Name: diethyl 4-(5-bromanyl-2-methoxy-phenyl)-1-propan-2-yl-4H-pyridine-3,5-dicarboxylate Openeye Name: diethyl 4-(5-bromo-2-methoxy-phenyl)-1-isopropyl-4H-pyridine-3,5-dicarboxylate CAS Name: 4-(5-bromo-2-methoxyphenyl)-1-propan-2-yl-4H-pyridine-3,5-dicarboxylic acid diethyl ester IUPAC Name: diethyl 4-(5-bromo-2-methoxyphenyl)-1-propan-2-yl-4H-pyridine-3,5-dicarboxylate Traditional Name: 4-(5-bromo-2-methoxy-phenyl)-1-isopropyl-4H-pyridine-3,5-dicarboxylic acid diethyl ester Formula: C21H26BrNO5 MolecularWeight: 452.33884

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(C=C(C1C2=C(C=CC(=C2)Br)OC)C(=O)OCC)C(C)C

Isomeric SMILES

CCOC(=O)C1=CN(C=C(C1C2=C(C=CC(=C2)Br)OC)C(=O)OCC)C(C)C

InChI

InChI=1S/C21H26BrNO5/c1-6-27-20(24)16-11-23(13(3)4)12-17(21(25)28-7-2)19(16)15-10-14(22)8-9-18(15)26-5/h8-13,19H,6-7H2,1-5H3