1-phenyl-4-(prop-2-ynoxymethyl)pyrazole

Systemtic Name: 1-phenyl-4-(prop-2-ynoxymethyl)pyrazole Openeye Name: 1-phenyl-4-(prop-2-ynoxymethyl)pyrazole CAS Name: 1-phenyl-4-(prop-2-ynoxymethyl)pyrazole IUPAC Name: 1-phenyl-4-(prop-2-ynoxymethyl)pyrazole Traditional Name: 1-phenyl-4-(propargyloxymethyl)pyrazole Formula: C13H12N2O MolecularWeight: 212.24718

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Descriptors Computed from Structure

Canonical SMILES:

C#CCOCC1=CN(N=C1)C2=CC=CC=C2

Isomeric SMILES

C#CCOCC1=CN(N=C1)C2=CC=CC=C2

InChI

InChI=1S/C13H12N2O/c1-2-8-16-11-12-9-14-15(10-12)13-6-4-3-5-7-13/h1,3-7,9-10H,8,11H2