methyl 5-oxidanyl-1-(phenylcarbonyl)-5-propyl-4H-pyrazole-3-carboxylate

Systemtic Name: methyl 5-oxidanyl-1-(phenylcarbonyl)-5-propyl-4H-pyrazole-3-carboxylate Openeye Name: methyl 1-benzoyl-5-hydroxy-5-propyl-4H-pyrazole-3-carboxylate CAS Name: 1-benzoyl-5-hydroxy-5-propyl-4H-pyrazole-3-carboxylic acid methyl ester IUPAC Name: methyl 1-benzoyl-5-hydroxy-5-propyl-4H-pyrazole-3-carboxylate Traditional Name: 1-benzoyl-5-hydroxy-5-propyl-2-pyrazoline-3-carboxylic acid methyl ester Formula: C15H18N2O4 MolecularWeight: 290.31442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1(CC(=NN1C(=O)C2=CC=CC=C2)C(=O)OC)O

Isomeric SMILES

CCCC1(CC(=NN1C(=O)C2=CC=CC=C2)C(=O)OC)O

InChI

InChI=1S/C15H18N2O4/c1-3-9-15(20)10-12(14(19)21-2)16-17(15)13(18)11-7-5-4-6-8-11/h4-8,20H,3,9-10H2,1-2H3