3-nitroquinoline-4-sulfonic acid

Systemtic Name: 3-nitroquinoline-4-sulfonic acid Openeye Name: 3-nitroquinoline-4-sulfonic acid CAS Name: 3-nitro-4-quinolinesulfonic acid IUPAC Name: 3-nitroquinoline-4-sulfonic acid Traditional Name: 3-nitroquinoline-4-sulfonic acid Formula: C9H6N2O5S MolecularWeight: 254.21934

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H6N2O5S/c12-11(13)8-5-10-7-4-2-1-3-6(7)9(8)17(14,15)16/h1-5H,(H,14,15,16)