6,8-dinitro-5H-pyrimido[5,4-b]indole-2-carboxylic acid

Systemtic Name: 6,8-dinitro-5H-pyrimido[5,4-b]indole-2-carboxylic acid Openeye Name: 6,8-dinitro-5H-pyrimido[5,4-b]indole-2-carboxylic acid CAS Name: 6,8-dinitro-5H-pyrimido[5,4-b]indole-2-carboxylic acid IUPAC Name: 6,8-dinitro-5H-pyrimido[5,4-b]indole-2-carboxylic acid Traditional Name: 6,8-dinitro-5H-pyrimid[5,4-b]indole-2-carboxylic acid Formula: C11H5N5O6 MolecularWeight: 303.1873

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C2C(=C1[N+](=O)[O-])NC3=CN=C(N=C23)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=C(C=C2C(=C1[N+](=O)[O-])NC3=CN=C(N=C23)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C11H5N5O6/c17-11(18)10-12-3-6-8(14-10)5-1-4(15(19)20)2-7(16(21)22)9(5)13-6/h1-3,13H,(H,17,18)