5-[4-(2-methylpropylamino)phenyl]-1,2-dihydropyrazol-3-one

Systemtic Name: 5-[4-(2-methylpropylamino)phenyl]-1,2-dihydropyrazol-3-one Openeye Name: 5-[4-(isobutylamino)phenyl]-1,2-dihydropyrazol-3-one CAS Name: 5-[4-(2-methylpropylamino)phenyl]-1,2-dihydropyrazol-3-one IUPAC Name: 5-[4-(2-methylpropylamino)phenyl]-1,2-dihydropyrazol-3-one Traditional Name: 5-[4-(isobutylamino)phenyl]-3-pyrazolin-3-one Formula: C13H17N3O MolecularWeight: 231.29358

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC1=CC=C(C=C1)C2=CC(=O)NN2

Isomeric SMILES

CC(C)CNC1=CC=C(C=C1)C2=CC(=O)NN2

InChI

InChI=1S/C13H17N3O/c1-9(2)8-14-11-5-3-10(4-6-11)12-7-13(17)16-15-12/h3-7,9,14H,8H2,1-2H3,(H2,15,16,17)