3,5-dihexyl-4-pentyl-1-(phenylmethyl)pyrazole

Systemtic Name: 3,5-dihexyl-4-pentyl-1-(phenylmethyl)pyrazole Openeye Name: 1-benzyl-3,5-dihexyl-4-pentyl-pyrazole CAS Name: 3,5-dihexyl-4-pentyl-1-(phenylmethyl)pyrazole IUPAC Name: 1-benzyl-3,5-dihexyl-4-pentylpyrazole Traditional Name: 4-amyl-1-benzyl-3,5-dihexyl-pyrazole Formula: C27H44N2 MolecularWeight: 396.65166

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C(=NN1CC2=CC=CC=C2)CCCCCC)CCCCC

Isomeric SMILES

CCCCCCC1=C(C(=NN1CC2=CC=CC=C2)CCCCCC)CCCCC

InChI

InChI=1S/C27H44N2/c1-4-7-10-16-21-26-25(20-13-9-6-3)27(22-17-11-8-5-2)29(28-26)23-24-18-14-12-15-19-24/h12,14-15,18-19H,4-11,13,16-17,20-23H2,1-3H3