1-(4-oxidanyl-2-phenyl-3H-pyrazol-4-yl)dodecan-1-one

Systemtic Name: 1-(4-oxidanyl-2-phenyl-3H-pyrazol-4-yl)dodecan-1-one Openeye Name: 1-(4-hydroxy-2-phenyl-3H-pyrazol-4-yl)dodecan-1-one CAS Name: 1-(4-hydroxy-2-phenyl-3H-pyrazol-4-yl)-1-dodecanone IUPAC Name: 1-(4-hydroxy-2-phenyl-3H-pyrazol-4-yl)dodecan-1-one Traditional Name: 1-(4-hydroxy-1-phenyl-2-pyrazolin-4-yl)dodecan-1-one Formula: C21H32N2O2 MolecularWeight: 344.49098

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)C1(CN(N=C1)C2=CC=CC=C2)O

Isomeric SMILES

CCCCCCCCCCCC(=O)C1(CN(N=C1)C2=CC=CC=C2)O

InChI

InChI=1S/C21H32N2O2/c1-2-3-4-5-6-7-8-9-13-16-20(24)21(25)17-22-23(18-21)19-14-11-10-12-15-19/h10-12,14-15,17,25H,2-9,13,16,18H2,1H3