5-(1-adamantylcarbamoyl)-1-methyl-pyrazole-4-carboxylic acid

Systemtic Name: 5-(1-adamantylcarbamoyl)-1-methyl-pyrazole-4-carboxylic acid Openeye Name: 5-(1-adamantylcarbamoyl)-1-methyl-pyrazole-4-carboxylic acid CAS Name: 5-[(1-adamantylamino)-oxomethyl]-1-methyl-4-pyrazolecarboxylic acid IUPAC Name: 5-(1-adamantylcarbamoyl)-1-methylpyrazole-4-carboxylic acid Traditional Name: 5-(1-adamantylcarbamoyl)-1-methyl-pyrazole-4-carboxylic acid Formula: C16H21N3O3 MolecularWeight: 303.35624

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)C(=O)O)C(=O)NC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CN1C(=C(C=N1)C(=O)O)C(=O)NC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C16H21N3O3/c1-19-13(12(8-17-19)15(21)22)14(20)18-16-5-9-2-10(6-16)4-11(3-9)7-16/h8-11H,2-7H2,1H3,(H,18,20)(H,21,22)