[2-[1-(1-adamantyl)ethylamino]-2-oxidanylidene-ethyl] quinoline-2-carboxylate

Systemtic Name: [2-[1-(1-adamantyl)ethylamino]-2-oxidanylidene-ethyl] quinoline-2-carboxylate Openeye Name: [2-[1-(1-adamantyl)ethylamino]-2-oxo-ethyl] quinoline-2-carboxylate CAS Name: 2-quinolinecarboxylic acid [2-[1-(1-adamantyl)ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[1-(1-adamantyl)ethylamino]-2-oxoethyl] quinoline-2-carboxylate Traditional Name: quinaldic acid [2-[1-(1-adamantyl)ethylamino]-2-keto-ethyl] ester Formula: C24H28N2O3 MolecularWeight: 392.49072

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Descriptors Computed from Structure

Canonical SMILES:

CC(C12CC3CC(C1)CC(C3)C2)NC(=O)COC(=O)C4=NC5=CC=CC=C5C=C4

Isomeric SMILES

CC(C12CC3CC(C1)CC(C3)C2)NC(=O)COC(=O)C4=NC5=CC=CC=C5C=C4

InChI

InChI=1S/C24H28N2O3/c1-15(24-11-16-8-17(12-24)10-18(9-16)13-24)25-22(27)14-29-23(28)21-7-6-19-4-2-3-5-20(19)26-21/h2-7,15-18H,8-14H2,1H3,(H,25,27)