7-azanyl-3-bromanyl-5-nitro-2-oxidanyl-cyclohepta-2,4,6-trien-1-one

Systemtic Name: 7-azanyl-3-bromanyl-5-nitro-2-oxidanyl-cyclohepta-2,4,6-trien-1-one Openeye Name: 7-amino-3-bromo-2-hydroxy-5-nitro-cyclohepta-2,4,6-trien-1-one CAS Name: 7-amino-3-bromo-2-hydroxy-5-nitro-1-cyclohepta-2,4,6-trienone IUPAC Name: 7-amino-3-bromo-2-hydroxy-5-nitrocyclohepta-2,4,6-trien-1-one Traditional Name: 7-amino-3-bromo-2-hydroxy-5-nitro-cyclohepta-2,4,6-trien-1-one Formula: C7H5BrN2O4 MolecularWeight: 261.0296

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=O)C(=C1Br)O)N)[N+](=O)[O-]

Isomeric SMILES

C1=C(C=C(C(=O)C(=C1Br)O)N)[N+](=O)[O-]

InChI

InChI=1S/C7H5BrN2O4/c8-4-1-3(10(13)14)2-5(9)7(12)6(4)11/h1-2H,(H3,9,11,12)