5-propoxy-1H-pyrazole hydrate

Systemtic Name: 5-propoxy-1H-pyrazole hydrate Openeye Name: 5-propoxy-1H-pyrazole hydrate CAS Name: 5-propoxy-1H-pyrazole hydrate IUPAC Name: 5-propoxy-1H-pyrazole hydrate Traditional Name: 5-propoxy-1H-pyrazole hydrate Formula: C12H22N4O3 MolecularWeight: 270.32808

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=NN1.CCCOC1=CC=NN1.O

Isomeric SMILES

CCCOC1=CC=NN1.CCCOC1=CC=NN1.O

InChI

InChI=1S/2C6H10N2O.H2O/c2*1-2-5-9-6-3-4-7-8-6;/h2*3-4H,2,5H2,1H3,(H,7,8);1H2