5-(2-hydroxyphenyl)-4-octyl-1,2-dihydropyrazol-3-one

Systemtic Name: 5-(2-hydroxyphenyl)-4-octyl-1,2-dihydropyrazol-3-one Openeye Name: 5-(2-hydroxyphenyl)-4-octyl-1,2-dihydropyrazol-3-one CAS Name: 5-(2-hydroxyphenyl)-4-octyl-1,2-dihydropyrazol-3-one IUPAC Name: 5-(2-hydroxyphenyl)-4-octyl-1,2-dihydropyrazol-3-one Traditional Name: 5-(2-hydroxyphenyl)-4-octyl-3-pyrazolin-3-one Formula: C17H24N2O2 MolecularWeight: 288.38466

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=C(NNC1=O)C2=CC=CC=C2O

Isomeric SMILES

CCCCCCCCC1=C(NNC1=O)C2=CC=CC=C2O

InChI

InChI=1S/C17H24N2O2/c1-2-3-4-5-6-7-11-14-16(18-19-17(14)21)13-10-8-9-12-15(13)20/h8-10,12,20H,2-7,11H2,1H3,(H2,18,19,21)