7-nitronaphthalene-1,3,6-trisulfonic acid

Systemtic Name: 7-nitronaphthalene-1,3,6-trisulfonic acid Openeye Name: 7-nitronaphthalene-1,3,6-trisulfonic acid CAS Name: 7-nitronaphthalene-1,3,6-trisulfonic acid IUPAC Name: 7-nitronaphthalene-1,3,6-trisulfonic acid Traditional Name: 7-nitronaphthalene-1,3,6-trisulfonic acid Formula: C10H7NO11S3 MolecularWeight: 413.35768

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Descriptors Computed from Structure

Canonical SMILES:

C1=C2C=C(C=C(C2=CC(=C1S(=O)(=O)O)[N+](=O)[O-])S(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

C1=C2C=C(C=C(C2=CC(=C1S(=O)(=O)O)[N+](=O)[O-])S(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C10H7NO11S3/c12-11(13)8-4-7-5(2-10(8)25(20,21)22)1-6(23(14,15)16)3-9(7)24(17,18)19/h1-4H,(H,14,15,16)(H,17,18,19)(H,20,21,22)