8-[(3-aminophenyl)sulfonylamino]naphthalene-1,3,6-trisulfonic acid

Systemtic Name: 8-[(3-aminophenyl)sulfonylamino]naphthalene-1,3,6-trisulfonic acid Openeye Name: 8-[(3-aminophenyl)sulfonylamino]naphthalene-1,3,6-trisulfonic acid CAS Name: 8-[(3-aminophenyl)sulfonylamino]naphthalene-1,3,6-trisulfonic acid IUPAC Name: 8-[(3-aminophenyl)sulfonylamino]naphthalene-1,3,6-trisulfonic acid Traditional Name: 8-[(3-aminophenyl)sulfonylamino]naphthalene-1,3,6-trisulfonic acid Formula: C16H14N2O11S4 MolecularWeight: 538.54916

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)S(=O)(=O)NC2=C3C(=CC(=C2)S(=O)(=O)O)C=C(C=C3S(=O)(=O)O)S(=O)(=O)O)N

Isomeric SMILES

C1=CC(=CC(=C1)S(=O)(=O)NC2=C3C(=CC(=C2)S(=O)(=O)O)C=C(C=C3S(=O)(=O)O)S(=O)(=O)O)N

InChI

InChI=1S/C16H14N2O11S4/c17-10-2-1-3-11(6-10)30(19,20)18-14-7-12(31(21,22)23)4-9-5-13(32(24,25)26)8-15(16(9)14)33(27,28)29/h1-8,18H,17H2,(H,21,22,23)(H,24,25,26)(H,27,28,29)