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

Systemtic Name: dimethyl 1-(1-adamantylmethyl)-4-(3-methoxy-4-oxidanyl-phenyl)-4H-pyridine-3,5-dicarboxylate Openeye Name: dimethyl 1-(1-adamantylmethyl)-4-(4-hydroxy-3-methoxy-phenyl)-4H-pyridine-3,5-dicarboxylate CAS Name: 1-(1-adamantylmethyl)-4-(4-hydroxy-3-methoxyphenyl)-4H-pyridine-3,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 1-(1-adamantylmethyl)-4-(4-hydroxy-3-methoxyphenyl)-4H-pyridine-3,5-dicarboxylate Traditional Name: 1-(1-adamantylmethyl)-4-(4-hydroxy-3-methoxy-phenyl)-4H-pyridine-3,5-dicarboxylic acid dimethyl ester Formula: C27H33NO6 MolecularWeight: 467.55402

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2C(=CN(C=C2C(=O)OC)CC34CC5CC(C3)CC(C5)C4)C(=O)OC)O

Isomeric SMILES

COC1=C(C=CC(=C1)C2C(=CN(C=C2C(=O)OC)CC34CC5CC(C3)CC(C5)C4)C(=O)OC)O

InChI

InChI=1S/C27H33NO6/c1-32-23-9-19(4-5-22(23)29)24-20(25(30)33-2)13-28(14-21(24)26(31)34-3)15-27-10-16-6-17(11-27)8-18(7-16)12-27/h4-5,9,13-14,16-18,24,29H,6-8,10-12,15H2,1-3H3