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

Systemtic Name: dimethyl 4-(5-bromanyl-2-methoxy-phenyl)-1-cyclohexyl-4H-pyridine-3,5-dicarboxylate Openeye Name: dimethyl 4-(5-bromo-2-methoxy-phenyl)-1-cyclohexyl-4H-pyridine-3,5-dicarboxylate CAS Name: 4-(5-bromo-2-methoxyphenyl)-1-cyclohexyl-4H-pyridine-3,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 4-(5-bromo-2-methoxyphenyl)-1-cyclohexyl-4H-pyridine-3,5-dicarboxylate Traditional Name: 4-(5-bromo-2-methoxy-phenyl)-1-cyclohexyl-4H-pyridine-3,5-dicarboxylic acid dimethyl ester Formula: C22H26BrNO5 MolecularWeight: 464.34954

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C2C(=CN(C=C2C(=O)OC)C3CCCCC3)C(=O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)Br)C2C(=CN(C=C2C(=O)OC)C3CCCCC3)C(=O)OC

InChI

InChI=1S/C22H26BrNO5/c1-27-19-10-9-14(23)11-16(19)20-17(21(25)28-2)12-24(13-18(20)22(26)29-3)15-7-5-4-6-8-15/h9-13,15,20H,4-8H2,1-3H3