5-methyl-8-nitro-4-oxidanylidene-pyrano[3,2-b]indole-2-carboxylic acid

Systemtic Name: 5-methyl-8-nitro-4-oxidanylidene-pyrano[3,2-b]indole-2-carboxylic acid Openeye Name: 5-methyl-8-nitro-4-oxo-pyrano[3,2-b]indole-2-carboxylic acid CAS Name: 5-methyl-8-nitro-4-oxo-2-pyrano[3,2-b]indolecarboxylic acid IUPAC Name: 5-methyl-8-nitro-4-oxopyrano[3,2-b]indole-2-carboxylic acid Traditional Name: 4-keto-5-methyl-8-nitro-pyran[3,2-b]indole-2-carboxylic acid Formula: C13H8N2O6 MolecularWeight: 288.21242

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)[N+](=O)[O-])C3=C1C(=O)C=C(O3)C(=O)O

Isomeric SMILES

CN1C2=C(C=C(C=C2)[N+](=O)[O-])C3=C1C(=O)C=C(O3)C(=O)O

InChI

InChI=1S/C13H8N2O6/c1-14-8-3-2-6(15(19)20)4-7(8)12-11(14)9(16)5-10(21-12)13(17)18/h2-5H,1H3,(H,17,18)