dimethyl 1-(1-adamantyl)-4-(3,4,5-trimethoxyphenyl)-4H-pyridine-3,5-dicarboxylate

Systemtic Name: dimethyl 1-(1-adamantyl)-4-(3,4,5-trimethoxyphenyl)-4H-pyridine-3,5-dicarboxylate Openeye Name: dimethyl 1-(1-adamantyl)-4-(3,4,5-trimethoxyphenyl)-4H-pyridine-3,5-dicarboxylate CAS Name: 1-(1-adamantyl)-4-(3,4,5-trimethoxyphenyl)-4H-pyridine-3,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 1-(1-adamantyl)-4-(3,4,5-trimethoxyphenyl)-4H-pyridine-3,5-dicarboxylate Traditional Name: 1-(1-adamantyl)-4-(3,4,5-trimethoxyphenyl)-4H-pyridine-3,5-dicarboxylic acid dimethyl ester Formula: C28H35NO7 MolecularWeight: 497.58

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2C(=CN(C=C2C(=O)OC)C34CC5CC(C3)CC(C5)C4)C(=O)OC

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2C(=CN(C=C2C(=O)OC)C34CC5CC(C3)CC(C5)C4)C(=O)OC

InChI

InChI=1S/C28H35NO7/c1-32-22-9-19(10-23(33-2)25(22)34-3)24-20(26(30)35-4)14-29(15-21(24)27(31)36-5)28-11-16-6-17(12-28)8-18(7-16)13-28/h9-10,14-18,24H,6-8,11-13H2,1-5H3