ethyl 5-(1-adamantylmethylcarbamoyl)-1-methyl-pyrazole-3-carboxylate

Systemtic Name: ethyl 5-(1-adamantylmethylcarbamoyl)-1-methyl-pyrazole-3-carboxylate Openeye Name: ethyl 5-(1-adamantylmethylcarbamoyl)-1-methyl-pyrazole-3-carboxylate CAS Name: 5-[(1-adamantylmethylamino)-oxomethyl]-1-methyl-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(1-adamantylmethylcarbamoyl)-1-methylpyrazole-3-carboxylate Traditional Name: 5-(1-adamantylmethylcarbamoyl)-1-methyl-pyrazole-3-carboxylic acid ethyl ester Formula: C19H27N3O3 MolecularWeight: 345.43598

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=C1)C(=O)NCC23CC4CC(C2)CC(C4)C3)C

Isomeric SMILES

CCOC(=O)C1=NN(C(=C1)C(=O)NCC23CC4CC(C2)CC(C4)C3)C

InChI

InChI=1S/C19H27N3O3/c1-3-25-18(24)15-7-16(22(2)21-15)17(23)20-11-19-8-12-4-13(9-19)6-14(5-12)10-19/h7,12-14H,3-6,8-11H2,1-2H3,(H,20,23)