3,4-dimethyl-5-pentyl-1-phenyl-pyrazole

Systemtic Name: 3,4-dimethyl-5-pentyl-1-phenyl-pyrazole Openeye Name: 3,4-dimethyl-5-pentyl-1-phenyl-pyrazole CAS Name: 3,4-dimethyl-5-pentyl-1-phenylpyrazole IUPAC Name: 3,4-dimethyl-5-pentyl-1-phenylpyrazole Traditional Name: 5-amyl-3,4-dimethyl-1-phenyl-pyrazole Formula: C16H22N2 MolecularWeight: 242.35928

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(C(=NN1C2=CC=CC=C2)C)C

Isomeric SMILES

CCCCCC1=C(C(=NN1C2=CC=CC=C2)C)C

InChI

InChI=1S/C16H22N2/c1-4-5-7-12-16-13(2)14(3)17-18(16)15-10-8-6-9-11-15/h6,8-11H,4-5,7,12H2,1-3H3