3,5,5-trimethyl-1-(5-pentyl-4-phenyl-3,4-dihydropyrazol-2-yl)hexan-1-one

Systemtic Name: 3,5,5-trimethyl-1-(5-pentyl-4-phenyl-3,4-dihydropyrazol-2-yl)hexan-1-one Openeye Name: 3,5,5-trimethyl-1-(5-pentyl-4-phenyl-3,4-dihydropyrazol-2-yl)hexan-1-one CAS Name: 3,5,5-trimethyl-1-(5-pentyl-4-phenyl-3,4-dihydropyrazol-2-yl)-1-hexanone IUPAC Name: 3,5,5-trimethyl-1-(5-pentyl-4-phenyl-3,4-dihydropyrazol-2-yl)hexan-1-one Traditional Name: 1-(3-amyl-4-phenyl-2-pyrazolin-1-yl)-3,5,5-trimethyl-hexan-1-one Formula: C23H36N2O MolecularWeight: 356.54474

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=NN(CC1C2=CC=CC=C2)C(=O)CC(C)CC(C)(C)C

Isomeric SMILES

CCCCCC1=NN(CC1C2=CC=CC=C2)C(=O)CC(C)CC(C)(C)C

InChI

InChI=1S/C23H36N2O/c1-6-7-9-14-21-20(19-12-10-8-11-13-19)17-25(24-21)22(26)15-18(2)16-23(3,4)5/h8,10-13,18,20H,6-7,9,14-17H2,1-5H3