2-azanyl-3-nitro-quinoline-4-sulfonic acid

Systemtic Name: 2-azanyl-3-nitro-quinoline-4-sulfonic acid Openeye Name: 2-amino-3-nitro-quinoline-4-sulfonic acid CAS Name: 2-amino-3-nitro-4-quinolinesulfonic acid IUPAC Name: 2-amino-3-nitroquinoline-4-sulfonic acid Traditional Name: 2-amino-3-nitro-quinoline-4-sulfonic acid Formula: C9H7N3O5S MolecularWeight: 269.23398

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(C(=N2)N)[N+](=O)[O-])S(=O)(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(C(=N2)N)[N+](=O)[O-])S(=O)(=O)O

InChI

InChI=1S/C9H7N3O5S/c10-9-7(12(13)14)8(18(15,16)17)5-3-1-2-4-6(5)11-9/h1-4H,(H2,10,11)(H,15,16,17)