5-[(2-chlorophenyl)carbonylamino]-4-oxidanyl-7-(trioxidanylsulfanyl)naphthalene-2-sulfonic acid

Systemtic Name: 5-[(2-chlorophenyl)carbonylamino]-4-oxidanyl-7-(trioxidanylsulfanyl)naphthalene-2-sulfonic acid Openeye Name: 5-[(2-chlorobenzoyl)amino]-4-hydroxy-7-(trioxidanylsulfanyl)naphthalene-2-sulfonic acid CAS Name: 5-[[(2-chlorophenyl)-oxomethyl]amino]-4-hydroxy-7-(trioxidanylthio)-2-naphthalenesulfonic acid IUPAC Name: 5-[(2-chlorobenzoyl)amino]-4-hydroxy-7-(trioxidanylsulfanyl)naphthalene-2-sulfonic acid Traditional Name: 5-[(2-chlorobenzoyl)amino]-4-hydroxy-7-(trioxidanylthio)naphthalene-2-sulfonic acid Formula: C17H12ClNO8S2 MolecularWeight: 457.86208

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H12ClNO8S2/c18-13-4-2-1-3-12(13)17(21)19-14-7-10(28-27-26-22)5-9-6-11(29(23,24)25)8-15(20)16(9)14/h1-8,20,22H,(H,19,21)(H,23,24,25)