5-(5-methyl-3-oxidanylidene-2-phenyl-1H-pyrazol-4-yl)pentanoic acid

Systemtic Name: 5-(5-methyl-3-oxidanylidene-2-phenyl-1H-pyrazol-4-yl)pentanoic acid Openeye Name: 5-(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)pentanoic acid CAS Name: 5-(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)pentanoic acid IUPAC Name: 5-(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)pentanoic acid Traditional Name: 5-(5-keto-3-methyl-1-phenyl-3-pyrazolin-4-yl)valeric acid Formula: C15H18N2O3 MolecularWeight: 274.31502

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1)C2=CC=CC=C2)CCCCC(=O)O

Isomeric SMILES

CC1=C(C(=O)N(N1)C2=CC=CC=C2)CCCCC(=O)O

InChI

InChI=1S/C15H18N2O3/c1-11-13(9-5-6-10-14(18)19)15(20)17(16-11)12-7-3-2-4-8-12/h2-4,7-8,16H,5-6,9-10H2,1H3,(H,18,19)