3-isothiocyanatonaphthalene-1,5-disulfonate

Systemtic Name: 3-isothiocyanatonaphthalene-1,5-disulfonate Openeye Name: 3-isothiocyanatonaphthalene-1,5-disulfonate CAS Name: 3-isothiocyanatonaphthalene-1,5-disulfonate IUPAC Name: 3-isothiocyanatonaphthalene-1,5-disulfonate Traditional Name: 3-isothiocyanatonaphthalene-1,5-disulfonate Formula: C11H5NO6S3-2 MolecularWeight: 343.3555

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C(C=C2C(=C1)S(=O)(=O)[O-])N=C=S)S(=O)(=O)[O-]

Isomeric SMILES

C1=CC2=C(C=C(C=C2C(=C1)S(=O)(=O)[O-])N=C=S)S(=O)(=O)[O-]

InChI

InChI=1S/C11H7NO6S3/c13-20(14,15)10-3-1-2-8-9(10)4-7(12-6-19)5-11(8)21(16,17)18/h1-5H,(H,13,14,15)(H,16,17,18)/p-2