2-[(3-azanyl-4-naphthalen-2-ylsulfonyl-phenyl)sulfonylamino]naphthalene-1-sulfonic acid

Systemtic Name: 2-[(3-azanyl-4-naphthalen-2-ylsulfonyl-phenyl)sulfonylamino]naphthalene-1-sulfonic acid Openeye Name: 2-[[3-amino-4-(2-naphthylsulfonyl)phenyl]sulfonylamino]naphthalene-1-sulfonic acid CAS Name: 2-[[3-amino-4-(2-naphthalenylsulfonyl)phenyl]sulfonylamino]-1-naphthalenesulfonic acid IUPAC Name: 2-[(3-amino-4-naphthalen-2-ylsulfonylphenyl)sulfonylamino]naphthalene-1-sulfonic acid Traditional Name: 2-[[3-amino-4-(2-naphthylsulfonyl)phenyl]sulfonylamino]naphthalene-1-sulfonic acid Formula: C26H20N2O7S3 MolecularWeight: 568.6412

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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(C5=CC=CC=C5C=C4)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(C5=CC=CC=C5C=C4)S(=O)(=O)O)N

InChI

InChI=1S/C26H20N2O7S3/c27-23-16-21(12-14-25(23)36(29,30)20-11-9-17-5-1-2-7-19(17)15-20)37(31,32)28-24-13-10-18-6-3-4-8-22(18)26(24)38(33,34)35/h1-16,28H,27H2,(H,33,34,35)