4-[(3-ethenylsulfonylphenyl)carbonylamino]-5-oxidanyl-naphthalene-1,7-disulfonic acid

Systemtic Name: 4-[(3-ethenylsulfonylphenyl)carbonylamino]-5-oxidanyl-naphthalene-1,7-disulfonic acid Openeye Name: 5-hydroxy-4-[(3-vinylsulfonylbenzoyl)amino]naphthalene-1,7-disulfonic acid CAS Name: 4-[[(3-ethenylsulfonylphenyl)-oxomethyl]amino]-5-hydroxynaphthalene-1,7-disulfonic acid IUPAC Name: 4-[(3-ethenylsulfonylbenzoyl)amino]-5-hydroxynaphthalene-1,7-disulfonic acid Traditional Name: 5-hydroxy-4-[(3-vinylsulfonylbenzoyl)amino]naphthalene-1,7-disulfonic acid Formula: C19H15NO10S3 MolecularWeight: 513.5181

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H15NO10S3/c1-2-31(23,24)12-5-3-4-11(8-12)19(22)20-15-6-7-17(33(28,29)30)14-9-13(32(25,26)27)10-16(21)18(14)15/h2-10,21H,1H2,(H,20,22)(H,25,26,27)(H,28,29,30)