4-[(3-ethenylsulfonylphenyl)carbonylamino]-5-oxidanyl-naphthalene-2,7-disulfonic acid

Systemtic Name: 4-[(3-ethenylsulfonylphenyl)carbonylamino]-5-oxidanyl-naphthalene-2,7-disulfonic acid Openeye Name: 4-hydroxy-5-[(3-vinylsulfonylbenzoyl)amino]naphthalene-2,7-disulfonic acid CAS Name: 4-[[(3-ethenylsulfonylphenyl)-oxomethyl]amino]-5-hydroxynaphthalene-2,7-disulfonic acid IUPAC Name: 4-[(3-ethenylsulfonylbenzoyl)amino]-5-hydroxynaphthalene-2,7-disulfonic acid Traditional Name: 4-hydroxy-5-[(3-vinylsulfonylbenzoyl)amino]naphthalene-2,7-disulfonic acid Formula: C19H15NO10S3 MolecularWeight: 513.5181

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CS(=O)(=O)C1=CC=CC(=C1)C(=O)NC2=C3C(=CC(=C2)S(=O)(=O)O)C=C(C=C3O)S(=O)(=O)O

Isomeric SMILES

C=CS(=O)(=O)C1=CC=CC(=C1)C(=O)NC2=C3C(=CC(=C2)S(=O)(=O)O)C=C(C=C3O)S(=O)(=O)O

InChI

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