3-(1-adamantylamino)-5-methyl-1H-pyrazole-4-carboxylic acid

Systemtic Name: 3-(1-adamantylamino)-5-methyl-1H-pyrazole-4-carboxylic acid Openeye Name: 3-(1-adamantylamino)-5-methyl-1H-pyrazole-4-carboxylic acid CAS Name: 3-(1-adamantylamino)-5-methyl-1H-pyrazole-4-carboxylic acid IUPAC Name: 3-(1-adamantylamino)-5-methyl-1H-pyrazole-4-carboxylic acid Traditional Name: 3-(1-adamantylamino)-5-methyl-1H-pyrazole-4-carboxylic acid Formula: C15H21N3O2 MolecularWeight: 275.34614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)NC23CC4CC(C2)CC(C4)C3)C(=O)O

Isomeric SMILES

CC1=C(C(=NN1)NC23CC4CC(C2)CC(C4)C3)C(=O)O

InChI

InChI=1S/C15H21N3O2/c1-8-12(14(19)20)13(18-17-8)16-15-5-9-2-10(6-15)4-11(3-9)7-15/h9-11H,2-7H2,1H3,(H,19,20)(H2,16,17,18)