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

Systemtic Name: (4Z)-4-[1-(2,2-dimethoxyethylamino)ethylidene]-2-(4-nitrophenyl)-5-propyl-pyrazol-3-one Openeye Name: (4Z)-4-[1-(2,2-dimethoxyethylamino)ethylidene]-2-(4-nitrophenyl)-5-propyl-pyrazol-3-one CAS Name: (4Z)-4-[1-(2,2-dimethoxyethylamino)ethylidene]-2-(4-nitrophenyl)-5-propyl-3-pyrazolone IUPAC Name: (4Z)-4-[1-(2,2-dimethoxyethylamino)ethylidene]-2-(4-nitrophenyl)-5-propylpyrazol-3-one Traditional Name: (4Z)-4-[1-(2,2-dimethoxyethylamino)ethylidene]-2-(4-nitrophenyl)-5-propyl-2-pyrazolin-3-one Formula: C18H24N4O5 MolecularWeight: 376.40696

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H24N4O5/c1-5-6-15-17(12(2)19-11-16(26-3)27-4)18(23)21(20-15)13-7-9-14(10-8-13)22(24)25/h7-10,16,19H,5-6,11H2,1-4H3/b17-12-