[3,5-dimethyl-5-oxidanyl-4-(phenylmethyl)-4H-pyrazol-1-yl]-pyridin-4-yl-methanone

Systemtic Name: [3,5-dimethyl-5-oxidanyl-4-(phenylmethyl)-4H-pyrazol-1-yl]-pyridin-4-yl-methanone Openeye Name: (4-benzyl-5-hydroxy-3,5-dimethyl-4H-pyrazol-1-yl)-(4-pyridyl)methanone CAS Name: [5-hydroxy-3,5-dimethyl-4-(phenylmethyl)-4H-pyrazol-1-yl]-pyridin-4-ylmethanone IUPAC Name: (4-benzyl-5-hydroxy-3,5-dimethyl-4H-pyrazol-1-yl)-pyridin-4-ylmethanone Traditional Name: (4-benzyl-5-hydroxy-3,5-dimethyl-2-pyrazolin-1-yl)-(4-pyridyl)methanone Formula: C18H19N3O2 MolecularWeight: 309.36236

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(C1CC2=CC=CC=C2)(C)O)C(=O)C3=CC=NC=C3

Isomeric SMILES

CC1=NN(C(C1CC2=CC=CC=C2)(C)O)C(=O)C3=CC=NC=C3

InChI

InChI=1S/C18H19N3O2/c1-13-16(12-14-6-4-3-5-7-14)18(2,23)21(20-13)17(22)15-8-10-19-11-9-15/h3-11,16,23H,12H2,1-2H3