[2-[1-adamantyl(furan-2-ylmethyl)amino]-2-oxidanylidene-ethyl] 6-morpholin-4-ylpyridine-3-carboxylate

Systemtic Name: [2-[1-adamantyl(furan-2-ylmethyl)amino]-2-oxidanylidene-ethyl] 6-morpholin-4-ylpyridine-3-carboxylate Openeye Name: [2-[1-adamantyl(2-furylmethyl)amino]-2-oxo-ethyl] 6-morpholinopyridine-3-carboxylate CAS Name: 6-(4-morpholinyl)-3-pyridinecarboxylic acid [2-[1-adamantyl(2-furanylmethyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[1-adamantyl(furan-2-ylmethyl)amino]-2-oxoethyl] 6-morpholin-4-ylpyridine-3-carboxylate Traditional Name: 6-morpholinonicotinic acid [2-[1-adamantyl(2-furfuryl)amino]-2-keto-ethyl] ester Formula: C27H33N3O5 MolecularWeight: 479.56802

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NC=C(C=C2)C(=O)OCC(=O)N(CC3=CC=CO3)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

C1COCCN1C2=NC=C(C=C2)C(=O)OCC(=O)N(CC3=CC=CO3)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C27H33N3O5/c31-25(18-35-26(32)22-3-4-24(28-16-22)29-5-8-33-9-6-29)30(17-23-2-1-7-34-23)27-13-19-10-20(14-27)12-21(11-19)15-27/h1-4,7,16,19-21H,5-6,8-15,17-18H2