2-[(3-azanyl-4-naphthalen-2-ylsulfonyl-phenyl)sulfonylamino]benzene-1,4-disulfonic acid

Systemtic Name: 2-[(3-azanyl-4-naphthalen-2-ylsulfonyl-phenyl)sulfonylamino]benzene-1,4-disulfonic acid Openeye Name: 2-[[3-amino-4-(2-naphthylsulfonyl)phenyl]sulfonylamino]benzene-1,4-disulfonic acid CAS Name: 2-[[3-amino-4-(2-naphthalenylsulfonyl)phenyl]sulfonylamino]benzene-1,4-disulfonic acid IUPAC Name: 2-[(3-amino-4-naphthalen-2-ylsulfonylphenyl)sulfonylamino]benzene-1,4-disulfonic acid Traditional Name: 2-[[3-amino-4-(2-naphthylsulfonyl)phenyl]sulfonylamino]benzene-1,4-disulfonic acid Formula: C22H18N2O10S4 MolecularWeight: 598.64572

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)S(=O)(=O)C3=C(C=C(C=C3)S(=O)(=O)NC4=C(C=CC(=C4)S(=O)(=O)O)S(=O)(=O)O)N

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)S(=O)(=O)C3=C(C=C(C=C3)S(=O)(=O)NC4=C(C=CC(=C4)S(=O)(=O)O)S(=O)(=O)O)N

InChI

InChI=1S/C22H18N2O10S4/c23-19-12-17(7-9-21(19)35(25,26)16-6-5-14-3-1-2-4-15(14)11-16)36(27,28)24-20-13-18(37(29,30)31)8-10-22(20)38(32,33)34/h1-13,24H,23H2,(H,29,30,31)(H,32,33,34)