N-butyl-5,6-dinitro-indazole-1-carboxamide

Systemtic Name: N-butyl-5,6-dinitro-indazole-1-carboxamide Openeye Name: N-butyl-5,6-dinitro-indazole-1-carboxamide CAS Name: N-butyl-5,6-dinitro-1-indazolecarboxamide IUPAC Name: N-butyl-5,6-dinitroindazole-1-carboxamide Traditional Name: N-butyl-5,6-dinitro-indazole-1-carboxamide Formula: C12H13N5O5 MolecularWeight: 307.26212

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)N1C2=CC(=C(C=C2C=N1)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCCCNC(=O)N1C2=CC(=C(C=C2C=N1)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C12H13N5O5/c1-2-3-4-13-12(18)15-9-6-11(17(21)22)10(16(19)20)5-8(9)7-14-15/h5-7H,2-4H2,1H3,(H,13,18)