4-butyl-1-methyl-3-phenyl-pyrazole

Systemtic Name: 4-butyl-1-methyl-3-phenyl-pyrazole Openeye Name: 4-butyl-1-methyl-3-phenyl-pyrazole CAS Name: 4-butyl-1-methyl-3-phenylpyrazole IUPAC Name: 4-butyl-1-methyl-3-phenylpyrazole Traditional Name: 4-butyl-1-methyl-3-phenyl-pyrazole Formula: C14H18N2 MolecularWeight: 214.30612

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CN(N=C1C2=CC=CC=C2)C

Isomeric SMILES

CCCCC1=CN(N=C1C2=CC=CC=C2)C

InChI

InChI=1S/C14H18N2/c1-3-4-8-13-11-16(2)15-14(13)12-9-6-5-7-10-12/h5-7,9-11H,3-4,8H2,1-2H3