2-(2-methylpropyl)-3-nitro-6-phenyl-5H-pyrazolo[1,5-d][1,2,4]triazine-4,7-dione

Systemtic Name: 2-(2-methylpropyl)-3-nitro-6-phenyl-5H-pyrazolo[1,5-d][1,2,4]triazine-4,7-dione Openeye Name: 2-isobutyl-3-nitro-6-phenyl-5H-pyrazolo[1,5-d][1,2,4]triazine-4,7-dione CAS Name: 2-(2-methylpropyl)-3-nitro-6-phenyl-5H-pyrazolo[1,5-d][1,2,4]triazine-4,7-dione IUPAC Name: 2-(2-methylpropyl)-3-nitro-6-phenyl-5H-pyrazolo[1,5-d][1,2,4]triazine-4,7-dione Traditional Name: 2-isobutyl-3-nitro-6-phenyl-5H-pyrazolo[1,5-d][1,2,4]triazine-4,7-quinone Formula: C15H15N5O4 MolecularWeight: 329.3107

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=NN2C(=C1[N+](=O)[O-])C(=O)NN(C2=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)CC1=NN2C(=C1[N+](=O)[O-])C(=O)NN(C2=O)C3=CC=CC=C3

InChI

InChI=1S/C15H15N5O4/c1-9(2)8-11-12(20(23)24)13-14(21)17-18(15(22)19(13)16-11)10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3,(H,17,21)