5-nitro-1-[(3-nitrophenyl)methyl]-2H-indazol-3-one

Systemtic Name: 5-nitro-1-[(3-nitrophenyl)methyl]-2H-indazol-3-one Openeye Name: 5-nitro-1-[(3-nitrophenyl)methyl]-2H-indazol-3-one CAS Name: 5-nitro-1-[(3-nitrophenyl)methyl]-2H-indazol-3-one IUPAC Name: 5-nitro-1-[(3-nitrophenyl)methyl]-2H-indazol-3-one Traditional Name: 5-nitro-1-(3-nitrobenzyl)indazolin-3-one Formula: C14H10N4O5 MolecularWeight: 314.253

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])CN2C3=C(C=C(C=C3)[N+](=O)[O-])C(=O)N2

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])CN2C3=C(C=C(C=C3)[N+](=O)[O-])C(=O)N2

InChI

InChI=1S/C14H10N4O5/c19-14-12-7-11(18(22)23)4-5-13(12)16(15-14)8-9-2-1-3-10(6-9)17(20)21/h1-7H,8H2,(H,15,19)