dimethyl 4-(3-bromanyl-5-ethoxy-4-oxidanyl-phenyl)-1-cyclohexyl-4H-pyridine-3,5-dicarboxylate

Systemtic Name: dimethyl 4-(3-bromanyl-5-ethoxy-4-oxidanyl-phenyl)-1-cyclohexyl-4H-pyridine-3,5-dicarboxylate Openeye Name: dimethyl 4-(3-bromo-5-ethoxy-4-hydroxy-phenyl)-1-cyclohexyl-4H-pyridine-3,5-dicarboxylate CAS Name: 4-(3-bromo-5-ethoxy-4-hydroxyphenyl)-1-cyclohexyl-4H-pyridine-3,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 4-(3-bromo-5-ethoxy-4-hydroxyphenyl)-1-cyclohexyl-4H-pyridine-3,5-dicarboxylate Traditional Name: 4-(3-bromo-5-ethoxy-4-hydroxy-phenyl)-1-cyclohexyl-4H-pyridine-3,5-dicarboxylic acid dimethyl ester Formula: C23H28BrNO6 MolecularWeight: 494.37552

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C2C(=CN(C=C2C(=O)OC)C3CCCCC3)C(=O)OC)Br)O

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C2C(=CN(C=C2C(=O)OC)C3CCCCC3)C(=O)OC)Br)O

InChI

InChI=1S/C23H28BrNO6/c1-4-31-19-11-14(10-18(24)21(19)26)20-16(22(27)29-2)12-25(13-17(20)23(28)30-3)15-8-6-5-7-9-15/h10-13,15,20,26H,4-9H2,1-3H3