4-[[3-(diethylamino)propylamino]methylidene]-2-(4-nitrophenyl)-5-propyl-pyrazol-3-one

Systemtic Name: 4-[[3-(diethylamino)propylamino]methylidene]-2-(4-nitrophenyl)-5-propyl-pyrazol-3-one Openeye Name: 4-[[3-(diethylamino)propylamino]methylene]-2-(4-nitrophenyl)-5-propyl-pyrazol-3-one CAS Name: 4-[[3-(diethylamino)propylamino]methylidene]-2-(4-nitrophenyl)-5-propyl-3-pyrazolone IUPAC Name: 4-[[3-(diethylamino)propylamino]methylidene]-2-(4-nitrophenyl)-5-propylpyrazol-3-one Traditional Name: 4-[[3-(diethylamino)propylamino]methylene]-2-(4-nitrophenyl)-5-propyl-2-pyrazolin-3-one Formula: C20H29N5O3 MolecularWeight: 387.47596

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H29N5O3/c1-4-8-19-18(15-21-13-7-14-23(5-2)6-3)20(26)24(22-19)16-9-11-17(12-10-16)25(27)28/h9-12,15,21H,4-8,13-14H2,1-3H3