dimethyl 4-(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)-1-cyclopropyl-4H-pyridine-3,5-dicarboxylate

Systemtic Name: dimethyl 4-(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)-1-cyclopropyl-4H-pyridine-3,5-dicarboxylate Openeye Name: dimethyl 4-(3-bromo-4-hydroxy-5-methoxy-phenyl)-1-cyclopropyl-4H-pyridine-3,5-dicarboxylate CAS Name: 4-(3-bromo-4-hydroxy-5-methoxyphenyl)-1-cyclopropyl-4H-pyridine-3,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 4-(3-bromo-4-hydroxy-5-methoxyphenyl)-1-cyclopropyl-4H-pyridine-3,5-dicarboxylate Traditional Name: 4-(3-bromo-4-hydroxy-5-methoxy-phenyl)-1-cyclopropyl-4H-pyridine-3,5-dicarboxylic acid dimethyl ester Formula: C19H20BrNO6 MolecularWeight: 438.2692

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C2C(=CN(C=C2C(=O)OC)C3CC3)C(=O)OC)Br)O

Isomeric SMILES

COC1=C(C(=CC(=C1)C2C(=CN(C=C2C(=O)OC)C3CC3)C(=O)OC)Br)O

InChI

InChI=1S/C19H20BrNO6/c1-25-15-7-10(6-14(20)17(15)22)16-12(18(23)26-2)8-21(11-4-5-11)9-13(16)19(24)27-3/h6-9,11,16,22H,4-5H2,1-3H3