disodium 8-azanyl-6-sulfo-naphthalene-1,3-disulfonate

Systemtic Name: disodium 8-azanyl-6-sulfo-naphthalene-1,3-disulfonate Openeye Name: disodium 8-amino-6-sulfo-naphthalene-1,3-disulfonate CAS Name: disodium 8-amino-6-sulfonaphthalene-1,3-disulfonate IUPAC Name: disodium 8-amino-6-sulfonaphthalene-1,3-disulfonate Traditional Name: disodium 8-amino-6-sulfo-naphthalene-1,3-disulfonate Formula: C10H7NNa2O9S3 MolecularWeight: 427.33842

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H9NO9S3.2Na/c11-8-3-6(21(12,13)14)1-5-2-7(22(15,16)17)4-9(10(5)8)23(18,19)20;;/h1-4H,11H2,(H,12,13,14)(H,15,16,17)(H,18,19,20);;/q;2*+1/p-2