4-[(4-aminophenyl)sulfonylamino]naphthalene-1,6-disulfonic acid

Systemtic Name: 4-[(4-aminophenyl)sulfonylamino]naphthalene-1,6-disulfonic acid Openeye Name: 4-[(4-aminophenyl)sulfonylamino]naphthalene-1,6-disulfonic acid CAS Name: 4-[(4-aminophenyl)sulfonylamino]naphthalene-1,6-disulfonic acid IUPAC Name: 4-[(4-aminophenyl)sulfonylamino]naphthalene-1,6-disulfonic acid Traditional Name: 4-(sulfanilylamino)naphthalene-1,6-disulfonic acid Formula: C16H14N2O8S3 MolecularWeight: 458.48596

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N)S(=O)(=O)NC2=C3C=C(C=CC3=C(C=C2)S(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

C1=CC(=CC=C1N)S(=O)(=O)NC2=C3C=C(C=CC3=C(C=C2)S(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C16H14N2O8S3/c17-10-1-3-11(4-2-10)27(19,20)18-15-7-8-16(29(24,25)26)13-6-5-12(9-14(13)15)28(21,22)23/h1-9,18H,17H2,(H,21,22,23)(H,24,25,26)