4-azanyl-5-tert-butyl-1-methyl-2-(3-nitrophenyl)pyrazol-3-one

Systemtic Name: 4-azanyl-5-tert-butyl-1-methyl-2-(3-nitrophenyl)pyrazol-3-one Openeye Name: 4-amino-5-tert-butyl-1-methyl-2-(3-nitrophenyl)pyrazol-3-one CAS Name: 4-amino-5-tert-butyl-1-methyl-2-(3-nitrophenyl)-3-pyrazolone IUPAC Name: 4-amino-5-tert-butyl-1-methyl-2-(3-nitrophenyl)pyrazol-3-one Traditional Name: 4-amino-5-tert-butyl-1-methyl-2-(3-nitrophenyl)-3-pyrazolin-3-one Formula: C14H18N4O3 MolecularWeight: 290.31772

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C(=O)N(N1C)C2=CC(=CC=C2)[N+](=O)[O-])N

Isomeric SMILES

CC(C)(C)C1=C(C(=O)N(N1C)C2=CC(=CC=C2)[N+](=O)[O-])N

InChI

InChI=1S/C14H18N4O3/c1-14(2,3)12-11(15)13(19)17(16(12)4)9-6-5-7-10(8-9)18(20)21/h5-8H,15H2,1-4H3