methyl 5-[2-(1-adamantyloxy)ethylcarbamoyl]-2-methyl-pyrazole-3-carboxylate

Systemtic Name: methyl 5-[2-(1-adamantyloxy)ethylcarbamoyl]-2-methyl-pyrazole-3-carboxylate Openeye Name: methyl 5-[2-(1-adamantyloxy)ethylcarbamoyl]-2-methyl-pyrazole-3-carboxylate CAS Name: 5-[[2-(1-adamantyloxy)ethylamino]-oxomethyl]-2-methyl-3-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 5-[2-(1-adamantyloxy)ethylcarbamoyl]-2-methylpyrazole-3-carboxylate Traditional Name: 5-[2-(1-adamantyloxy)ethylcarbamoyl]-2-methyl-pyrazole-3-carboxylic acid methyl ester Formula: C19H27N3O4 MolecularWeight: 361.43538

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=N1)C(=O)NCCOC23CC4CC(C2)CC(C4)C3)C(=O)OC

Isomeric SMILES

CN1C(=CC(=N1)C(=O)NCCOC23CC4CC(C2)CC(C4)C3)C(=O)OC

InChI

InChI=1S/C19H27N3O4/c1-22-16(18(24)25-2)8-15(21-22)17(23)20-3-4-26-19-9-12-5-13(10-19)7-14(6-12)11-19/h8,12-14H,3-7,9-11H2,1-2H3,(H,20,23)