(4Z)-4-[1-(3-oxidanylpropylamino)ethylidene]-2-phenyl-5-propyl-pyrazol-3-one

Systemtic Name: (4Z)-4-[1-(3-oxidanylpropylamino)ethylidene]-2-phenyl-5-propyl-pyrazol-3-one Openeye Name: (4Z)-4-[1-(3-hydroxypropylamino)ethylidene]-2-phenyl-5-propyl-pyrazol-3-one CAS Name: (4Z)-4-[1-(3-hydroxypropylamino)ethylidene]-2-phenyl-5-propyl-3-pyrazolone IUPAC Name: (4Z)-4-[1-(3-hydroxypropylamino)ethylidene]-2-phenyl-5-propylpyrazol-3-one Traditional Name: (4Z)-4-[1-(3-hydroxypropylamino)ethylidene]-2-phenyl-5-propyl-2-pyrazolin-3-one Formula: C17H23N3O2 MolecularWeight: 301.38342

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=O)C1=C(C)NCCCO)C2=CC=CC=C2

Isomeric SMILES

CCCC\1=NN(C(=O)/C1=C(/C)\NCCCO)C2=CC=CC=C2

InChI

InChI=1S/C17H23N3O2/c1-3-8-15-16(13(2)18-11-7-12-21)17(22)20(19-15)14-9-5-4-6-10-14/h4-6,9-10,18,21H,3,7-8,11-12H2,1-2H3/b16-13-