methyl 5-[2-[4-(1-adamantyl)phenoxy]ethanoylamino]pyridine-3-carboxylate

Systemtic Name: methyl 5-[2-[4-(1-adamantyl)phenoxy]ethanoylamino]pyridine-3-carboxylate Openeye Name: methyl 5-[[2-[4-(1-adamantyl)phenoxy]acetyl]amino]pyridine-3-carboxylate CAS Name: 5-[[2-[4-(1-adamantyl)phenoxy]-1-oxoethyl]amino]-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 5-[[2-[4-(1-adamantyl)phenoxy]acetyl]amino]pyridine-3-carboxylate Traditional Name: 5-[[2-[4-(1-adamantyl)phenoxy]acetyl]amino]nicotinic acid methyl ester Formula: C25H28N2O4 MolecularWeight: 420.50082

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CN=C1)NC(=O)COC2=CC=C(C=C2)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

COC(=O)C1=CC(=CN=C1)NC(=O)COC2=CC=C(C=C2)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C25H28N2O4/c1-30-24(29)19-9-21(14-26-13-19)27-23(28)15-31-22-4-2-20(3-5-22)25-10-16-6-17(11-25)8-18(7-16)12-25/h2-5,9,13-14,16-18H,6-8,10-12,15H2,1H3,(H,27,28)