dimethyl 1-[2-(1-adamantyloxy)ethyl]-4-(5-methylthiophen-2-yl)-4H-pyridine-3,5-dicarboxylate

Systemtic Name: dimethyl 1-[2-(1-adamantyloxy)ethyl]-4-(5-methylthiophen-2-yl)-4H-pyridine-3,5-dicarboxylate Openeye Name: dimethyl 1-[2-(1-adamantyloxy)ethyl]-4-(5-methyl-2-thienyl)-4H-pyridine-3,5-dicarboxylate CAS Name: 1-[2-(1-adamantyloxy)ethyl]-4-(5-methyl-2-thiophenyl)-4H-pyridine-3,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 1-[2-(1-adamantyloxy)ethyl]-4-(5-methylthiophen-2-yl)-4H-pyridine-3,5-dicarboxylate Traditional Name: 1-[2-(1-adamantyloxy)ethyl]-4-(5-methyl-2-thienyl)-4H-pyridine-3,5-dicarboxylic acid dimethyl ester Formula: C26H33NO5S MolecularWeight: 471.60892

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C2C(=CN(C=C2C(=O)OC)CCOC34CC5CC(C3)CC(C5)C4)C(=O)OC

Isomeric SMILES

CC1=CC=C(S1)C2C(=CN(C=C2C(=O)OC)CCOC34CC5CC(C3)CC(C5)C4)C(=O)OC

InChI

InChI=1S/C26H33NO5S/c1-16-4-5-22(33-16)23-20(24(28)30-2)14-27(15-21(23)25(29)31-3)6-7-32-26-11-17-8-18(12-26)10-19(9-17)13-26/h4-5,14-15,17-19,23H,6-13H2,1-3H3