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

Systemtic Name: (4Z)-4-[1-(2,2-dimethoxyethylamino)ethylidene]-5-methyl-2-(4-nitrophenyl)pyrazol-3-one Openeye Name: (4Z)-4-[1-(2,2-dimethoxyethylamino)ethylidene]-5-methyl-2-(4-nitrophenyl)pyrazol-3-one CAS Name: (4Z)-4-[1-(2,2-dimethoxyethylamino)ethylidene]-5-methyl-2-(4-nitrophenyl)-3-pyrazolone IUPAC Name: (4Z)-4-[1-(2,2-dimethoxyethylamino)ethylidene]-5-methyl-2-(4-nitrophenyl)pyrazol-3-one Traditional Name: (4Z)-4-[1-(2,2-dimethoxyethylamino)ethylidene]-5-methyl-2-(4-nitrophenyl)-2-pyrazolin-3-one Formula: C16H20N4O5 MolecularWeight: 348.3538

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=C(C)NCC(OC)OC)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C16H20N4O5/c1-10(17-9-14(24-3)25-4)15-11(2)18-19(16(15)21)12-5-7-13(8-6-12)20(22)23/h5-8,14,17H,9H2,1-4H3/b15-10-