(4Z)-2-(4-nitrophenyl)-4-[1-(3-propan-2-yloxypropylamino)ethylidene]-5-propyl-pyrazol-3-one

Systemtic Name: (4Z)-2-(4-nitrophenyl)-4-[1-(3-propan-2-yloxypropylamino)ethylidene]-5-propyl-pyrazol-3-one Openeye Name: (4Z)-4-[1-(3-isopropoxypropylamino)ethylidene]-2-(4-nitrophenyl)-5-propyl-pyrazol-3-one CAS Name: (4Z)-2-(4-nitrophenyl)-4-[1-(3-propan-2-yloxypropylamino)ethylidene]-5-propyl-3-pyrazolone IUPAC Name: (4Z)-2-(4-nitrophenyl)-4-[1-(3-propan-2-yloxypropylamino)ethylidene]-5-propylpyrazol-3-one Traditional Name: (4Z)-4-[1-(3-isopropoxypropylamino)ethylidene]-2-(4-nitrophenyl)-5-propyl-2-pyrazolin-3-one Formula: C20H28N4O4 MolecularWeight: 388.46072

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=O)C1=C(C)NCCCOC(C)C)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCCC\1=NN(C(=O)/C1=C(/C)\NCCCOC(C)C)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C20H28N4O4/c1-5-7-18-19(15(4)21-12-6-13-28-14(2)3)20(25)23(22-18)16-8-10-17(11-9-16)24(26)27/h8-11,14,21H,5-7,12-13H2,1-4H3/b19-15-