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trisodium 8-nitronaphthalene-1,3,5-trisulfonate

trisodium 8-nitronaphthalene-1,3,5-trisulfonate

Systemtic Name:trisodium 8-nitronaphthalene-1,3,5-trisulfonate
Openeye Name:trisodium 8-nitronaphthalene-1,3,5-trisulfonate
CAS Name:trisodium 8-nitronaphthalene-1,3,5-trisulfonate
IUPAC Name:trisodium 8-nitronaphthalene-1,3,5-trisulfonate
Traditional Name:trisodium 8-nitronaphthalene-1,3,5-trisulfonate
Formula: C10H4NNa3O11S3
MolecularWeight: 479.30317
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

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


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