3-[bis(cyclopropylmethyl)amino]-1H-pyrazole-5-carboxylic acid

Systemtic Name: 3-[bis(cyclopropylmethyl)amino]-1H-pyrazole-5-carboxylic acid Openeye Name: 3-[bis(cyclopropylmethyl)amino]-1H-pyrazole-5-carboxylic acid CAS Name: 3-[bis(cyclopropylmethyl)amino]-1H-pyrazole-5-carboxylic acid IUPAC Name: 3-[bis(cyclopropylmethyl)amino]-1H-pyrazole-5-carboxylic acid Traditional Name: 3-[bis(cyclopropylmethyl)amino]-1H-pyrazole-5-carboxylic acid Formula: C12H17N3O2 MolecularWeight: 235.28228

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1CN(CC2CC2)C3=NNC(=C3)C(=O)O

Isomeric SMILES

C1CC1CN(CC2CC2)C3=NNC(=C3)C(=O)O

InChI

InChI=1S/C12H17N3O2/c16-12(17)10-5-11(14-13-10)15(6-8-1-2-8)7-9-3-4-9/h5,8-9H,1-4,6-7H2,(H,13,14)(H,16,17)