3-[(3R)-5-methyl-3-phenyl-3,4-dihydropyrazol-2-yl]propanoic acid

Systemtic Name: 3-[(3R)-5-methyl-3-phenyl-3,4-dihydropyrazol-2-yl]propanoic acid Openeye Name: 3-[(3R)-5-methyl-3-phenyl-3,4-dihydropyrazol-2-yl]propanoic acid CAS Name: 3-[(3R)-5-methyl-3-phenyl-3,4-dihydropyrazol-2-yl]propanoic acid IUPAC Name: 3-[(3R)-5-methyl-3-phenyl-3,4-dihydropyrazol-2-yl]propanoic acid Traditional Name: 3-[(5R)-3-methyl-5-phenyl-2-pyrazolin-1-yl]propionic acid Formula: C13H16N2O2 MolecularWeight: 232.27834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(C1)C2=CC=CC=C2)CCC(=O)O

Isomeric SMILES

CC1=NN([C@H](C1)C2=CC=CC=C2)CCC(=O)O

InChI

InChI=1S/C13H16N2O2/c1-10-9-12(11-5-3-2-4-6-11)15(14-10)8-7-13(16)17/h2-6,12H,7-9H2,1H3,(H,16,17)/t12-/m1/s1