8-[(4-azanyl-2,5-dimethyl-phenyl)sulfonylamino]naphthalene-1,3,6-trisulfonic acid

Systemtic Name: 8-[(4-azanyl-2,5-dimethyl-phenyl)sulfonylamino]naphthalene-1,3,6-trisulfonic acid Openeye Name: 8-[(4-amino-2,5-dimethyl-phenyl)sulfonylamino]naphthalene-1,3,6-trisulfonic acid CAS Name: 8-[(4-amino-2,5-dimethylphenyl)sulfonylamino]naphthalene-1,3,6-trisulfonic acid IUPAC Name: 8-[(4-amino-2,5-dimethylphenyl)sulfonylamino]naphthalene-1,3,6-trisulfonic acid Traditional Name: 8-[(4-amino-2,5-dimethyl-phenyl)sulfonylamino]naphthalene-1,3,6-trisulfonic acid Formula: C18H18N2O11S4 MolecularWeight: 566.60232

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1S(=O)(=O)NC2=C3C(=CC(=C2)S(=O)(=O)O)C=C(C=C3S(=O)(=O)O)S(=O)(=O)O)C)N

Isomeric SMILES

CC1=CC(=C(C=C1S(=O)(=O)NC2=C3C(=CC(=C2)S(=O)(=O)O)C=C(C=C3S(=O)(=O)O)S(=O)(=O)O)C)N

InChI

InChI=1S/C18H18N2O11S4/c1-9-4-16(10(2)3-14(9)19)32(21,22)20-15-7-12(33(23,24)25)5-11-6-13(34(26,27)28)8-17(18(11)15)35(29,30)31/h3-8,20H,19H2,1-2H3,(H,23,24,25)(H,26,27,28)(H,29,30,31)