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

Systemtic Name: (4Z)-4-[1-(tert-butylamino)ethylidene]-5-methyl-2-(4-nitrophenyl)pyrazol-3-one Openeye Name: (4Z)-4-[1-(tert-butylamino)ethylidene]-5-methyl-2-(4-nitrophenyl)pyrazol-3-one CAS Name: (4Z)-4-[1-(tert-butylamino)ethylidene]-5-methyl-2-(4-nitrophenyl)-3-pyrazolone IUPAC Name: (4Z)-4-[1-(tert-butylamino)ethylidene]-5-methyl-2-(4-nitrophenyl)pyrazol-3-one Traditional Name: (4Z)-4-[1-(tert-butylamino)ethylidene]-5-methyl-2-(4-nitrophenyl)-2-pyrazolin-3-one Formula: C16H20N4O3 MolecularWeight: 316.355

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H20N4O3/c1-10(17-16(3,4)5)14-11(2)18-19(15(14)21)12-6-8-13(9-7-12)20(22)23/h6-9,17H,1-5H3/b14-10-